SCHEMBL24849446

SCHEMBL24849446

CC1(C)c2ccccc2-c2c1c(Cl)cc1c2sc2ccccc21

nearest known ligand 0.37

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 1/20 0.37
MAPT P10636 2/20 0.37
PARP14 Q460N5 1/20 0.35
SLC9A1 P19634 4/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
ATM Q13315 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 1/20 0.34
RAB9A P51151 1/20 0.34
GPR3 P46089 1/20 0.33
PGR P06401 2/20 0.33
TNKS O95271 1/20 0.32
TNKS2 Q9H2K2 1/20 0.32
PRKDC P78527 2/20 0.32
RXFP1 Q9HBX9 1/20 0.32
PDK2 Q15119 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
SCHEMBL17932247 0.79 ALOX5 (0.39) ALOX5MAPTPARP14SLC9A1L3MBTL1
SCHEMBL24352218 0.79 PARP14 (0.43) ALOX5MAPTPARP14SLC9A1KDM4E
SCHEMBL22920725 0.77 PGR (0.36) ALOX5MAPTPARP14SLC9A1L3MBTL1
SCHEMBL22920949 0.76 SLC9A1 (0.35) MAPTSLC9A1KDM4EALDH1A1GPR3
SCHEMBL22920955 0.76 PARP14 (0.38) ALOX5MAPTPARP14SLC9A1GPR3
SCHEMBL4554952 0.76 PARP14 (0.39) ALOX5MAPTPARP14L3MBTL1ATM
SCHEMBL17945364 0.75 ALOX5 (0.40) ALOX5MAPTPARP14SLC9A1L3MBTL1
SCHEMBL17944765 0.75 ALOX5 (0.36) ALOX5MAPTL3MBTL1ATMALDH1A1
SCHEMBL15982357 0.74 MAPT (0.36) ALOX5MAPTPARP14L3MBTL1ATM
SCHEMBL19081165 0.74 ALOX5 (0.39) ALOX5MAPTPARP14SLC9A1L3MBTL1

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-2023277446-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-01-05 WO disclosed