SCHEMBL420326

SCHEMBL420326

C=Cc1ccccc1/C(=C(\c1ccccc1)c1ccccc1/C(=C(\c1ccccc1)c1ccccc1C=C)c1ccccc1)c1ccccc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.40
AKT1 P31749 1/20 0.39
TSHR P16473 2/20 0.36
MAPT P10636 4/20 0.35
KDM4E B2RXH2 2/20 0.35
CYP3A4 P08684 2/20 0.35
HPGD P15428 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NFE2L2 Q16236 1/20 0.33
AKR1C3 P42330 1/20 0.33
NR4A2 P43354 1/20 0.33
CA12 O43570 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA9 Q16790 1/20 0.32
MAPK1 P28482 2/20 0.32
TDP1 Q9NUW8 2/20 0.32
ALOX15 P16050 2/20 0.32
CES1 P23141 2/20 0.32
MEN1 O00255 1/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL28335076 0.96 ALDH1A1 (0.40) ALDH1A1AKT1TSHRMAPTKDM4E
SCHEMBL28592723 0.85 ALDH1A1 (0.39) ALDH1A1AKT1TSHRMAPTKDM4E
SCHEMBL28809021 0.85 ALDH1A1 (0.35) ALDH1A1AKT1TSHRMAPTKDM4E
SCHEMBL7134178 0.81 ALDH1A1 (0.41) ALDH1A1AKT1TSHRMAPTKDM4E
SCHEMBL7930451 0.79 ALDH1A1 (0.40) ALDH1A1AKT1TSHRMAPTKDM4E
SCHEMBL173243 0.78 AKR1C3 (0.55) ALDH1A1AKT1MAPTKDM4EHPGD
SCHEMBL31727764 0.78 AKR1C3 (0.55) ALDH1A1AKT1MAPTKDM4EHPGD
SCHEMBL27612063 0.77 ALDH1A1 (0.54) ALDH1A1AKT1MAPTKDM4EHPGD
SCHEMBL2065186 0.76 CES2 (0.54) AKT1MAPTKDM4ECYP3A4HPGD
Ethane SCHEMBL27790628 0.76 MEN1 (0.40) ALDH1A1AKT1TSHRMAPTKDM4E

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10991890-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same DUK SAN NEOLUX CO., LTD. (KR) 2021-04-27 US disclosed
US-20180315931-A1 COMPOUND CONTAINING A 5-MEMBERED HETEROCYCLE AND ORGANIC LIGHT-EMITTING DIODE USING SAME, AND TERMINAL FOR SAME DUK SAN NEOLUX CO., LTD. (KR) 2018-11-01 US disclosed
US-10020452-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2018-07-10 US disclosed
US-9691990-B2 Compound, organic electronic element using same, and electronic device using the latter DUK SAN NEOLUX CO., LTD. (KR) 2017-06-27 US disclosed
US-9496520-B2 Organic electronic element including light efficiency improving layer, electronic device including the same, and compound for the same DUK SAN NEOLUX CO., LTD. (KR) 2016-11-15 US disclosed
US-9290513-B2 Compound containing 5-membered heterocycles, organic electronic device using same, and terminal comprising the latter DUK SAN NEOLUX CO., LTD. (KR) 2016-03-22 US disclosed
EP-2415773-B1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL DUK SAN NEOLUX CO LTD (KR) 2016-02-17 EP disclosed
US-9233923-B2 Organic compounds for organic electronic devices and terminals DUK SAN NEOLUX CO., LTD. (KR) 2016-01-12 US disclosed
US-9178163-B2 Compound comprising a five-membered hetero ring, an organic electrical element using same and a terminal thereof DUK SAN NEOLUX CO., LTD. (KR) 2015-11-03 US disclosed
US-20150307514-A1 COMPOUND CONTAINING 5-MEMBERED HETEROCYCLES, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL COMPRISING THE LATTER DUK SAN NEOLUX CO., LTD. (KR) 2015-10-29 US disclosed
US-20130334518-A1 COMPOUND AND ORGANIC ELECTRICAL ELEMENT USING SAME, AND ELECTRONIC DEVICE AND HEAT-RESISTANCE MEASURING METHOD THEREWITH DUKSAN HIGH METAL CO., LTD. (KR) 2013-12-19 US disclosed
US-8507904-B2 Compound including indole derivative, organic electronic element using same, and terminal thereof DUKSAN HIGH METAL CO., LTD. (KR) 2013-08-13 US disclosed
US-20130069049-A1 COMPOUND COMPRISING A FIVE-MEMBERED HETERO RING, AN ORGANIC ELECTRICAL ELEMENT USING THE SAME AND A TERMINAL THEREOF DUKSAN HIGH METAL CO., LTD. (KR) 2013-03-21 US disclosed
US-20130001540-A1 COMPOUND INCLUDING INDOLE DERIVATIVE IN WHICH TWO TERTIARY AMINES ARE SUBSTITUTED, ORGANIC ELECTRONIC ELEMENT USING SAME, AND TERMINAL THEREOF DUKSAN HIGH METAL CO., LTD. (KR) 2013-01-03 US disclosed
US-20120305906-A1 COMPOUND INCLUDING INDOLE DERIVATIVE, ORGANIC ELECTRONIC ELEMENT USING SAME, AND TERMINAL THEREOF DUKSAN HIGH METAL CO., LTD. (KR) 2012-12-06 US disclosed
US-20120217492-A1 ORGANIC COMPOUND, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL FOR SAME DUKSAN HIGH METAL CO., LTD. (KR) 2012-08-30 US disclosed
US-20120168734-A1 COMPOUND CONTAINING 5-MEMBERED HETEROCYCLES, ORGANIC LIGHT-EMITTING DEVICE USING SAME, AND TERMINAL COMPRISING THE LATTER DUKSAN HIGH METAL CO., LTD. (KR) 2012-07-05 US disclosed
US-20120080670-A1 COMPOUND CONTAINING A 5-MEMBERED HETEROCYCLE AND ORGANIC LIGHT-EMITTING DIODE USING SAME, AND TERMINAL FOR SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-04-05 US disclosed
EP-2415773-A2 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL Duksan Hi-Metal Co., Ltd. (KR) 2012-02-08 EP disclosed
US-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL DUKSAN HIGH METAL CO., LTD. (KR) 2012-01-26 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (10 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20120217492-A1 ORGANIC COMPOUND, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL FOR SAME OR10J3, OR51E2, ORC3 ALDH1A1 726/4885AKT1 4740/4885TSHR 3493/4885
US-20120168734-A1 COMPOUND CONTAINING 5-MEMBERED HETEROCYCLES, ORGANIC LIGHT-EMITTING DEVICE USING SAME, AND TERMINAL COMPRISING THE LATTER ORC3, OR10J3, SUN2 ALDH1A1 472/4885AKT1 4438/4885TSHR 4292/4885
US-20130001540-A1 COMPOUND INCLUDING INDOLE DERIVATIVE IN WHICH TWO TERTIARY AMINES ARE SUBSTITUTED, ORGANIC ELECTRONIC ELEMENT USING SAME, AND TERMINAL THEREOF INMT, IDO2, IDO1 ALDH1A1 295/4885AKT1 4555/4885TSHR 2425/4885
US-20150307514-A1 COMPOUND CONTAINING 5-MEMBERED HETEROCYCLES, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL COMPRISING THE LATTER EMC2, AOC2, MCM5 ALDH1A1 610/4885AKT1 3426/4885TSHR 4736/4885
US-10991890-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same NOTUM, OR10J3, PER2 ALDH1A1 210/4885AKT1 4265/4885TSHR 3518/4885
US-20120305906-A1 COMPOUND INCLUDING INDOLE DERIVATIVE, ORGANIC ELECTRONIC ELEMENT USING SAME, AND TERMINAL THEREOF INMT, IDO2, IDO1 ALDH1A1 857/4885AKT1 4287/4885TSHR 3448/4885
US-10020452-B2 Compound containing a 5-membered heterocycle and organic light-emitting diode using same, and terminal for same NOTUM, OR10J3, PER2 ALDH1A1 210/4885AKT1 4265/4885TSHR 3518/4885
US-20130069049-A1 COMPOUND COMPRISING A FIVE-MEMBERED HETERO RING, AN ORGANIC ELECTRICAL ELEMENT USING THE SAME AND A TERMINAL THEREOF VDAC2, OR10J3, VDAC1 ALDH1A1 3185/4885AKT1 3878/4885TSHR 4575/4885
US-20120080670-A1 COMPOUND CONTAINING A 5-MEMBERED HETEROCYCLE AND ORGANIC LIGHT-EMITTING DIODE USING SAME, AND TERMINAL FOR SAME NOTUM, OR10J3, PER2 ALDH1A1 210/4885AKT1 4265/4885TSHR 3518/4885
US-20120018717-A1 ORGANIC ELECTRONIC DEVICE, COMPOUNDS FOR SAME, AND TERMINAL OR10J3, OR51E2, ESR1 ALDH1A1 600/4885AKT1 4479/4885TSHR 3501/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.