SCHEMBL3366743

SCHEMBL3366743

Cc1ccccc1N(c1ccc(Br)cc1)c1ccccc1C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 6/20 0.39
LMNA P02545 3/20 0.37
TSHR P16473 2/20 0.36
ACHE P22303 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
L3MBTL1 Q9Y468 2/20 0.35
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPK1 P28482 1/20 0.34
CYP3A4 P08684 2/20 0.34
PTGES O14684 1/20 0.34
CYP2A6 P11509 1/20 0.33
CES2 O00748 1/20 0.33
CES1 P23141 1/20 0.33
SIGMAR1 Q99720 1/20 0.33
HDAC6 Q9UBN7 1/20 0.32
AHR P35869 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
SCHEMBL3364803 0.94 ALDH1A1 (0.45) ALDH1A1LMNATSHRACHENPC1
SCHEMBL4316561 0.89 RELA (0.42) ALDH1A1LMNANPC1RAB9AL3MBTL1
SCHEMBL2129885 0.89 ACHE (0.41) ALDH1A1LMNATSHRACHENPC1
SCHEMBL8943789 0.89 ACHE (0.45) ALDH1A1LMNATSHRACHEL3MBTL1
SCHEMBL17618197 0.88 PTGER1 (0.38) ALDH1A1LMNANPC1RAB9AL3MBTL1
SCHEMBL7486408 0.87 ACHE (0.43) ALDH1A1LMNATSHRACHEL3MBTL1
SCHEMBL4893894 0.87 ACHE (0.43) ALDH1A1LMNATSHRACHEL3MBTL1
SCHEMBL15768410 0.87 ALDH1A1 (0.44) ALDH1A1LMNATSHRL3MBTL1KMT2A
SCHEMBL2128397 0.86 CHRM5 (0.35) ALDH1A1LMNATSHRNPC1RAB9A
SCHEMBL13480247 0.83 TSHR (0.42) ALDH1A1LMNATSHRACHEL3MBTL1

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
EP-2535331-B1 Condensed-Cyclic Compound and Organic Light-Emitting Diode Comprising the Same SAMSUNG DISPLAY CO LTD (KR) 2016-05-11 EP disclosed
EP-2535331-B1 Condensed-Cyclic Compound and Organic Light-Emitting Diode Comprising the Same SAMSUNG DISPLAY CO LTD (KR) 2016-05-11 EP disclosed
US-9263681-B2 Organic light emitting host materials NITTO DENKO CORPORATION (JP) 2016-02-16 US disclosed
US-9263681-B2 Organic light emitting host materials NITTO DENKO CORPORATION (JP) 2016-02-16 US disclosed
US-9263681-B2 Organic light emitting host materials NITTO DENKO CORPORATION (JP) 2016-02-16 US disclosed
US-8974921-B2 Condensed-cyclic compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-10 US disclosed
US-8974921-B2 Condensed-cyclic compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-10 US disclosed
US-8974921-B2 Condensed-cyclic compound and organic light-emitting diode comprising the same SAMSUNG DISPLAY CO., LTD. (KR) 2015-03-10 US disclosed
WO-2014093353-A1 ORGANIC LIGHT EMITTING POLYAROMATIC AND POLYHETEROAROMATIC HOST MATERIALS NITTO DENKO CORPORATION (JP) 2014-06-19 WO disclosed
WO-2014093353-A1 ORGANIC LIGHT EMITTING POLYAROMATIC AND POLYHETEROAROMATIC HOST MATERIALS NITTO DENKO CORPORATION (JP) 2014-06-19 WO disclosed
US-20130001524-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2013-01-03 US disclosed
US-20120319086-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-12-20 US disclosed
US-20120319086-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-12-20 US disclosed
US-20120319086-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-12-20 US disclosed
EP-2535331-A1 Condensed-Cyclic Compound and Organic Light-Emitting Diode Comprising the Same Samsung Display Co., Ltd. (KR) 2012-12-19 EP disclosed
EP-2535331-A1 Condensed-Cyclic Compound and Organic Light-Emitting Diode Comprising the Same Samsung Display Co., Ltd. (KR) 2012-12-19 EP disclosed
US-8183393-B2 Dye compound and dye-sensitized solar cell ACADEMIA SINICA (TW) 2012-05-22 US disclosed
US-20120097924-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-04-26 US disclosed
US-20120097924-A1 ORGANIC LIGHT-EMITTING DEVICE SAMSUNG MOBILE DISPLAY CO., LTD. (KR) 2012-04-26 US disclosed
US-20100076205-A1 DYE COMPOUND AND DYE-SENSITIZED SOLAR CELL ACADEMIA SINICA (TW) 2010-03-25 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 (4 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-20130001524-A1 HETEROCYCLIC COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE COMPRISING THE SAME C9, C1S, C5 ALDH1A1 1072/4885LMNA 677/4885TSHR 2156/4885
US-20120319086-A1 CONDENSED-CYCLIC COMPOUND AND ORGANIC LIGHT EMITTING DIODE COMPRISING THE SAME CRY1, CRY2, CCNE2 ALDH1A1 890/4885LMNA 1548/4885TSHR 4208/4885
US-20120097924-A1 ORGANIC LIGHT-EMITTING DEVICE KCNT1, KCNA1, TRPA1 ALDH1A1 118/4885LMNA 1447/4885TSHR 3560/4885
US-20100076205-A1 DYE COMPOUND AND DYE-SENSITIZED SOLAR CELL CRY1, DSG1, CRY2 ALDH1A1 23/4885LMNA 2428/4885TSHR 3903/4885

“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.