SCHEMBL24856512

SCHEMBL24856512

c1ccc(-c2cccc(N(c3ccccc3)c3ccc4c5ccccc5n(-c5ccccc5)c4c3)c2-c2cccc3c2sc2ccccc23)cc1

nearest known ligand 0.35

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.35
KDM4E B2RXH2 1/20 0.34
ATM Q13315 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
PRKDC P78527 2/20 0.31
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
F9 P00740 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL25577437 0.94 ALOX5 (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25577303 0.94 ALOX5 (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25577345 0.91 ALOX5 (0.34) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25655372 0.90 ALOX5 (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25655377 0.90 ALOX5 (0.40) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25655359 0.89 ALOX5 (0.41) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL25577436 0.89 ALOX5 (0.38) ALOX5KDM4EATML3MBTL1PRKDC
SCHEMBL24856523 0.89 KDM4E (0.34) KDM4EATML3MBTL1F9HSD17B10
SCHEMBL24856569 0.89 KDM4E (0.34) KDM4EATML3MBTL1F9HSD17B10
SCHEMBL25655370 0.89 ALOX5 (0.41) ALOX5KDM4EATML3MBTL1PRKDC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023273997-A1 ORGANIC COMPOUND AND APPLICATION THEREOF 北京鼎材科技有限公司 2023-01-05 WO disclosed