SCHEMBL17883196

SCHEMBL17883196

CN(C)c1ccc(/C=C/C2=CC(=C(C#N)C#N)CC(C)(C)C2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.42
APP P05067 8/20 0.42
MEN1 O00255 6/20 0.41
KMT2A Q03164 6/20 0.41
MAPT P10636 6/20 0.41
ALDH1A1 P00352 4/20 0.41
RELA Q04206 1/20 0.39
PTGS1 P23219 1/20 0.38
RAB9A P51151 2/20 0.37
CASP1 P29466 2/20 0.37
HBB P68871 2/20 0.37
SMN1; SMN2 Q16637 2/20 0.37
NPC1 O15118 1/20 0.37
ALOX15 P16050 1/20 0.37
MAPK1 P28482 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
HSD17B3 P37058 1/20 0.36
GAA P10253 1/20 0.35
BRCA1 P38398 1/20 0.35
CASP7 P55210 1/20 0.35

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
SCHEMBL990372 1.00 KDM4E (0.42) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL17883192 0.87 MEN1 (0.34) APPMEN1KMT2AMAPTALDH1A1
SCHEMBL17072070 0.87 ALDH1A1 (0.40) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL8420809 0.86 MEN1 (0.32) MEN1KMT2AALDH1A1GAA
SCHEMBL1402754 0.86 MEN1 (0.35) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL1402757 0.86 MEN1 (0.35) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL28942803 0.85 APP (0.40) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL28963902 0.85 APP (0.38) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL28942820 0.85 APP (0.40) KDM4EAPPMEN1KMT2AMAPT
SCHEMBL28963901 0.85 APP (0.38) KDM4EAPPMEN1KMT2AMAPT

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11873293-B2 Organic molecules for optoelectronic devices SAMSUNG DISPLAY CO., LTD. (KR) 2024-01-16 US disclosed
US-20230337538-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-10-19 US disclosed
EP-3755695-B1 ORGANIC MOLECULES, ESPECIALLY FOR USE IN OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2023-10-11 EP disclosed
EP-3809479-B1 ORGANIC ELECTROLUMINESCENT DEVICE EMITTING BLUE LIGHT SAMSUNG DISPLAY CO LTD (KR) 2023-07-12 EP disclosed
US-20230209847-A1 ORGANIC LIGHT EMITTING ELEMENT KYULUX, INC. (JP) 2023-06-29 US disclosed
US-20230159567-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2023-05-25 US disclosed
EP-3892704-B1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO LTD (KR) 2023-05-17 EP disclosed
US-20230119624-A1 COMPOSITION, FILM, ORGANIC LIGHT EMITTING ELEMENT, METHOD FOR PROVIDING LIGHT EMITTING COMPOSITION, AND PROGRAM KYULUX, INC. (JP) 2023-04-20 US disclosed
US-20220285621-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2022-09-08 US disclosed
US-11384070-B2 Organic molecules for optoelectronic devices CYNORA GMBH (DE) 2022-07-12 US disclosed
US-20220123249-A1 ORGANIC LIGHT EMITTING ELEMENT KYULUX, INC. (JP) 2022-04-21 US disclosed
WO-2021241677-A1 ORGANIC LIGHT EMITTING ELEMENT 株式会社Kyulux 2021-12-02 WO disclosed
US-10862047-B2 Organic electroluminescent device KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2020-12-08 US disclosed
US-20200223831-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES SAMSUNG DISPLAY CO., LTD. (KR) 2020-07-16 US disclosed
US-10658596-B2 2020-05-19 US disclosed
US-20190177303-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES CYNORA GMBH (DE) 2019-06-13 US disclosed
CN-109354577-A It is a kind of using isophorone as the derivative of parent, preparation method and applications 江阴江化微电子材料股份有限公司 2019-02-19 CN disclosed
US-20160190478-A1 ORGANIC ELECTROLUMINESCENT DEVICE KYUSHU UNIVERSITY, NATIONAL UNIVERSITY CORPORATION (JP) 2016-06-30 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 (8 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-20220285621-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, ORC3, C5 KDM4E 4509/4885APP 3276/4885MEN1 4110/4885
US-20230337538-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OCIAD1, OCIAD2, OR10J3 KDM4E 2822/4885APP 2446/4885MEN1 2689/4885
US-20230159567-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES OR10J3, OXER1, OXSR1 KDM4E 2931/4885APP 2647/4885MEN1 3691/4885
US-20200223831-A1 ORGANIC MOLECULES FOR OPTOELECTRONIC DEVICES XDH, OR10J3, C1S KDM4E 4305/4885APP 2401/4885MEN1 2542/4885
US-11873293-B2 Organic molecules for optoelectronic devices XDH, C1S, OR10J3 KDM4E 4369/4885APP 2374/4885MEN1 2152/4885
US-20230119624-A1 COMPOSITION, FILM, ORGANIC LIGHT EMITTING ELEMENT, METHOD FOR PROVIDING LIGHT EMITTING COMPOSITION, AND PROGRAM SOS1, MLLT1, ESYT2 KDM4E 2093/4885APP 649/4885MEN1 546/4885
US-11384070-B2 Organic molecules for optoelectronic devices XDH, C1S, OR10J3 KDM4E 4225/4885APP 2415/4885MEN1 2306/4885
US-20190177303-A1 ORGANIC MOLECULES FOR USE IN OPTOELECTRONIC DEVICES OR10J3, ORC3, OR51E2 KDM4E 4001/4885APP 3064/4885MEN1 3148/4885

“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.