SCHEMBL26569834

SCHEMBL26569834

c1ccc(-c2cccc3cccc(-c4ccccc4N(c4ccccc4)c4ccccc4-c4cccc5c4sc4ccccc45)c23)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.40
PARP14 Q460N5 1/20 0.38
LIMK1 P53667 2/20 0.35
PRKDC P78527 4/20 0.33
PIK3CD O00329 2/20 0.33
PIK3CB P42338 2/20 0.33
ALDH1A1 P00352 2/20 0.33
TSHR P16473 2/20 0.33
MAPK1 P28482 2/20 0.33
HSD17B10 Q99714 2/20 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
F9 P00740 1/20 0.32
SLC9A1 P19634 1/20 0.32
BRD4 O60885 1/20 0.31
PIK3CA P42336 1/20 0.31
MTOR P42345 1/20 0.31
PIK3CG P48736 1/20 0.31

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
SCHEMBL26585038 0.95 ALOX5 (0.43) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26569840 0.95 ALOX5 (0.37) ALOX5PARP14LIMK1ALDH1A1TSHR
SCHEMBL26588508 0.94 ALOX5 (0.44) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26588298 0.94 ALOX5 (0.42) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26585036 0.94 ALOX5 (0.42) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26588245 0.93 ALOX5 (0.39) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26569457 0.93 ALOX5 (0.43) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26569829 0.93 ALOX5 (0.43) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26569463 0.93 ALOX5 (0.41) ALOX5PARP14LIMK1PRKDCPIK3CD
SCHEMBL26585175 0.92 ALOX5 (0.44) ALOX5PARP14LIMK1PRKDCPIK3CD

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