SCHEMBL21365560

SCHEMBL21365560

c1ccc(-c2ccc(-c3ccc(-c4nc(-c5ccccc5)nc(-c5cccc(-n6c7ccccc7c7c8sc9ccccc9c8ccc76)c5)n4)cc3)cc2)cc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
MAPT P10636 3/20 0.31
RXFP1 Q9HBX9 1/20 0.31
LIMK1 P53667 2/20 0.30
ADORA2A P29274 1/20 0.30
ADORA1 P30542 1/20 0.30
TP53 P04637 1/20 0.30

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
SCHEMBL21365857 1.00 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL21365855 0.98 ALOX5 (0.33) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL25133685 0.98 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL25133663 0.98 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL10014515 0.98 ATM (0.34) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL21365854 0.97 KDM4E (0.32) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL25134196 0.97 KDM4E (0.32) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL23595302 0.96 KDM4E (0.33) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL25133683 0.96 KDM4E (0.33) ALOX5KDM4EATML3MBTL1TNKS
SCHEMBL18564408 0.96 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3767698-B1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MAT CO LTD (JP) 2023-10-25 EP disclosed
US-20210119144-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL CHEMICAL & MATERIAL CO., LTD. (JP) 2021-04-22 US disclosed
EP-3767698-A1 ORGANIC ELECTROLUMINESCENT ELEMENT NIPPON STEEL Chemical & Material Co., Ltd. (JP) 2021-01-20 EP disclosed
WO-2019176605-A1 ORGANIC ELECTROLUMINESCENT ELEMENT 日鉄ケミカル&マテリアル株式会社 2019-09-19 WO disclosed