SCHEMBL26568461

SCHEMBL26568461

c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4sc4ccccc45)cc3)c3ccccc3-c3cccc4cccc(-c5ccccc5)c34)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.43
LIMK1 P53667 2/20 0.34
PARP14 Q460N5 1/20 0.34
PRKDC P78527 2/20 0.32
ALDH1A1 P00352 1/20 0.31
TSHR P16473 1/20 0.31
MAPK1 P28482 1/20 0.31
ATM Q13315 1/20 0.31
HSD17B10 Q99714 1/20 0.31
L3MBTL1 Q9Y468 1/20 0.31
TNKS O95271 1/20 0.31
TNKS2 Q9H2K2 1/20 0.31
F9 P00740 1/20 0.31
SLC9A1 P19634 1/20 0.31
MCL1 Q07820 1/20 0.30
PIK3CD O00329 1/20 0.30
PIK3CB P42338 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
SCHEMBL26585175 0.99 ALOX5 (0.44) ALOX5LIMK1PARP14PRKDCALDH1A1
SCHEMBL26569829 0.98 ALOX5 (0.43) ALOX5LIMK1PARP14PRKDCALDH1A1
SCHEMBL26588508 0.97 ALOX5 (0.44) ALOX5LIMK1PARP14PRKDCALDH1A1
SCHEMBL26585038 0.95 ALOX5 (0.43) ALOX5LIMK1PARP14PRKDCALDH1A1
SCHEMBL26569457 0.95 ALOX5 (0.43) ALOX5LIMK1PARP14PRKDCALDH1A1
SCHEMBL26569644 0.95 ALOX5 (0.45) ALOX5LIMK1PARP14PRKDCTNKS
SCHEMBL26584946 0.94 ALOX5 (0.43) ALOX5LIMK1PARP14PRKDCALDH1A1
SCHEMBL26569029 0.94 ALOX5 (0.41) ALOX5LIMK1PARP14PRKDCTNKS
SCHEMBL26585114 0.94 ALOX5 (0.46) ALOX5LIMK1PARP14PRKDCTNKS
SCHEMBL26568545 0.93 ALOX5 (0.38) ALOX5LIMK1PARP14ALDH1A1TSHR

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-2023182323-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENT, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-09-28 WO disclosed