SCHEMBL3759875

SCHEMBL3759875

c1ccc(Nc2cccc(Nc3ccccc3)n2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 6/20 1.00
MEN1 O00255 5/20 1.00
KMT2A Q03164 5/20 1.00
RAB9A P51151 2/20 1.00
TDP1 Q9NUW8 2/20 1.00
KDM4E B2RXH2 2/20 1.00
ALPG P10696 1/20 1.00
MAPK1 P28482 3/20 0.57
CDK2 P24941 2/20 0.57
ATM Q13315 2/20 0.57
CHEK1 O14757 1/20 0.57
IKBKB O14920 1/20 0.57
AURKA O14965 1/20 0.57
NPC1 O15118 1/20 0.57
PDPK1 O15530 1/20 0.57
CHEK2 O96017 1/20 0.57
PRKCG P05129 1/20 0.57
CDK1 P06493 1/20 0.57
LYN P07948 1/20 0.57
KIT P10721 1/20 0.57

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
SCHEMBL29466334 0.84 MAPT (0.72) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL26140602 0.84 MAPT (0.72) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL21258976 0.84 MAPT (0.72) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL7346798 0.84 MAPT (0.72) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL229427 0.84 RAB9A (0.72) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL3407973 0.84 MAPT (0.72) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL21390796 0.83 MAPT (0.69) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL12915423 0.81 MAPT (0.67) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL14308717 0.80 CDK2 (0.74) MAPTMEN1KMT2ARAB9ATDP1
SCHEMBL23006410 0.80 MAPT (0.64) MAPTMEN1KMT2ARAB9ATDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-7118234-A None JP disclosed
US-11581492-B2 Organic electroluminescence device and polycyclic compound for organic electroluminescence device SAMSUNG DISPLAY CO., LTD. (KR) 2023-02-14 US disclosed
CN-114163336-A Compound for reflective electrode protection layer and back light-emitting element comprising same 东进世美肯株式会社 2022-03-11 CN disclosed
US-20210143336-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE SAMSUNG DISPLAY CO., LTD. (KR) 2021-05-13 US disclosed
CN-105860070-A Tetracarboxylic acid derivatives, processes for producing same, and liquid-crystal alignment material 日产化学工业株式会社 2016-08-17 CN disclosed
US-7847099-B2 tridentate ligands bonded to metals, suitable as catalysts in the preparation of olefin polymers CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2010-12-07 US disclosed
US-20080177020-A1 tridentate ligands bonded to metals, suitable as catalysts in the preparation of olefin polymers CALIFORNIA INSTITUTE OF TECHNOLOGY 2008-07-24 US disclosed
WO-2008036882-A1 NON-METALLOCENE ORGANOMETALLIC COMPLEXES AND RELATED METHODS AND SYSTEMS CALIFORNIA INSTITUTE OF TECHNOLOGY (US) 2008-03-27 WO disclosed
EP-1877031-A2 HAIR COLOURING KITS AND METHODS OF USE THEREOF The Procter and Gamble Company (US) 2008-01-16 EP disclosed
WO-2006118942-A2 HAIR COLOURING KITS AND METHODS OF USE THEREOF THE PROCTER & GAMBLE COMPANY (US) 2006-11-09 WO disclosed
EP-0906321-A1 NOVEL TRANSITION METAL COMPLEXES AND METHOD FOR PREPARING THEM BOREALIS A/S (DK) 1999-04-07 EP disclosed
WO-1997045434-A1 NOVEL TRANSITION METAL COMPLEXES AND METHOD FOR PREPARING THEM BOREALIS A/S (DK) 1997-12-04 WO disclosed
JP-H07118234-A TETRAARYL-2,6-DIAMINOPYRIDINE DERIVATIVE AND ELECTROPHOTOGRAPHIC PHOTORECEPTOR USING THE SAME TAKASAGO INTERNATL CORP 1995-05-09 JP 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 (3 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-20210143336-A1 ORGANIC ELECTROLUMINESCENCE DEVICE AND POLYCYCLIC COMPOUND FOR ORGANIC ELECTROLUMINESCENCE DEVICE PIEZO1, LEF1, OCIAD1 MAPT 3280/4885MEN1 1288/4885KMT2A 1021/4885
US-20080177020-A1 tridentate ligands bonded to metals, suitable as catalysts in the preparation of olefin polymers TPR, POF1B, OSTC MAPT 438/4885MEN1 2744/4885KMT2A 1041/4885
US-11581492-B2 Organic electroluminescence device and polycyclic compound for organic electroluminescence device PIEZO1, LEF1, OCIAD1 MAPT 3280/4885MEN1 1288/4885KMT2A 1021/4885

“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.