SCHEMBL904484

SCHEMBL904484

COc1ccc(Nc2ccccn2)cc1

nearest known ligand 0.68

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 6/20 0.63
KMT2A Q03164 5/20 0.63
NPC1 O15118 5/20 0.63
NPSR1 Q6W5P4 2/20 0.63
MEN1 O00255 4/20 0.61
MAPT P10636 4/20 0.59
HTT P42858 3/20 0.59
ALDH1A1 P00352 2/20 0.59
GAA P10253 2/20 0.59
POLB P06746 1/20 0.58
MAPK1 P28482 3/20 0.57
LMNA P02545 1/20 0.57
F2 P00734 1/20 0.56
NFKB1 P19838 1/20 0.56
NFKB2 Q00653 1/20 0.56
RELA Q04206 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
KDM4E B2RXH2 1/20 0.55
THRB P10828 1/20 0.55
RECQL P46063 1/20 0.55

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
SCHEMBL30228630 1.00 RAB9A (0.63) RAB9AKMT2ANPC1NPSR1MEN1
SCHEMBL3860887 0.84 NPC1 (0.61) RAB9AKMT2ANPC1NPSR1MEN1
SCHEMBL2487582 0.83
SCHEMBL2489077 0.83
SCHEMBL24178149 0.82
SCHEMBL7968715 0.81 MEN1 (0.66) RAB9AKMT2ANPC1MEN1MAPT
SCHEMBL2485170 0.80
SCHEMBL1121223 0.79 RAB9A (0.67) RAB9AKMT2ANPC1NPSR1MEN1
SCHEMBL29408382 0.79 NPC1 (0.60) RAB9AKMT2ANPC1MEN1HTT
SCHEMBL904444 0.79 NPC1 (0.60) RAB9AKMT2ANPC1MEN1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250066355-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2025-02-27 US disclosed
US-12172998-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC. (US) 2024-12-24 US disclosed
US-11793070-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-10-17 US disclosed
US-11793070-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof DUK SAN NEOLUX CO., LTD. (KR) 2023-10-17 US disclosed
US-20230117519-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2023-04-20 US disclosed
US-20230117519-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. (US) 2023-04-20 US disclosed
CN-109988106-B Amine compound for inhibiting SSAO/VAP-1 and application thereof in medicine 广东东阳光药业有限公司 2023-03-31 CN disclosed
US-11535616-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC (US) 2022-12-27 US disclosed
US-11535616-B2 Histone demethylase inhibitors CELGENE QUANTICEL RESEARCH, INC (US) 2022-12-27 US disclosed
EP-3453710-B1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RES INC (US) 2022-09-21 EP disclosed
US-20160083379-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-03-24 US disclosed
US-20160083379-A1 HISTONE DEMETHYLASE INHIBITORS CELGENE QUANTICEL RESEARCH, INC. 2016-03-24 US disclosed
WO-2016013816-A1 ORGANIC ELECTRICAL ELEMENT USING COMPOUND FOR ORGANIC ELECTRICAL ELEMENT, AND ELECTRONIC DEVICE THEREOF 덕산네오룩스 주식회사 2016-01-28 WO disclosed
WO-2015041416-A1 ORGANIC ELECTRICAL ELEMENT USING COMPOUNDS FOR ORGANIC ELECTRICAL ELEMENT AND ELECTRONIC DEVICE THEREFOR 덕산네오룩스 주식회사 2015-03-26 WO disclosed
US-8637500-B2 Aminopyridine and carboxypyridine compounds as phosphodiesterase 10 inhibitors AMGEN INC. (US) 2014-01-28 US disclosed
WO-2012043996-A2 COMPOUND IN WHICH AMINE DERIVATIVE IS SUBSTITUTED WITH FLUORENE, ORGANIC ELECTRONIC DEVICE USING SAME, AND TERMINAL THEREOF 덕산하이메탈(주) (KR) 2012-04-05 WO disclosed
US-20100160280-A1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS AMGEN INC. (US) 2010-06-24 US disclosed
US-6235730-B1 ANTICHOLESTEROL AGENT, ANTILIPEMIC AGENT JAPAN TOBACCO, INC. (JP) 2001-05-22 US disclosed
EP-0970954-A1 3-PIPERIDYL-4-OXOQUINAZOLINE DERIVATIVES AND MEDICINCAL COMPOSITIONS CONTAINING THE SAME JAPAN TOBACCO INC. (JP) 2000-01-12 EP disclosed
WO-1997024328-A1 2-AMINO-HETEROCYCLES AND THERAPEUTIC USES THEREFOR BAYER AKTIENGESELLSCHAFT (DE) 1997-07-10 WO 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 (7 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-11793070-B2 Compound for organic electronic element, organic electronic element using the same, and electronic device thereof OR51E2, ETV6, OR10J3 RAB9A 3246/4885KMT2A 502/4885NPC1 3523/4885
US-12172998-B2 Histone demethylase inhibitors KDM1B, KDM1A, KDM5C RAB9A 3355/4885KMT2A 37/4885NPC1 4627/4885
US-20160083379-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C RAB9A 3355/4885KMT2A 37/4885NPC1 4627/4885
US-11535616-B2 Histone demethylase inhibitors KDM1B, KDM1A, KDM5C RAB9A 3355/4885KMT2A 37/4885NPC1 4627/4885
US-20230117519-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C RAB9A 3355/4885KMT2A 37/4885NPC1 4627/4885
US-20100160280-A1 AMINOPYRIDINE AND CARBOXYPYRIDINE COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS PDE4A, PDE7A, PDE4D RAB9A 452/4885KMT2A 2462/4885NPC1 4493/4885
US-20250066355-A1 HISTONE DEMETHYLASE INHIBITORS KDM1B, KDM1A, KDM5C RAB9A 3355/4885KMT2A 37/4885NPC1 4627/4885

“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.