SCHEMBL23816636

SCHEMBL23816636

c1ccc(-c2nc(-c3cccc4c3sc3ccccc34)nc(-c3ccc(-c4ccccc4)c4oc5ccccc5c34)n2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDC14B O60729 2/20 0.38
CDC14A Q9UNH5 2/20 0.38
ALOX5 P09917 1/20 0.38
PRKDC P78527 5/20 0.37
PIK3CD O00329 2/20 0.37
PIK3CB P42338 2/20 0.37
MAPT P10636 5/20 0.37
ALDH1A1 P00352 3/20 0.36
KDM4E B2RXH2 2/20 0.36
POLB P06746 2/20 0.36
NPSR1 Q6W5P4 1/20 0.36
TSHR P16473 3/20 0.34
HPGD P15428 1/20 0.34
LMNA P02545 3/20 0.34
HSD17B10 Q99714 2/20 0.34
MAPK1 P28482 1/20 0.34
BRD4 O60885 1/20 0.34
PIK3CA P42336 1/20 0.34
MTOR P42345 1/20 0.34
PIK3CG P48736 1/20 0.34

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
SCHEMBL23821619 0.96 CDC14B (0.37) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL22375875 0.94 PRKDC (0.38) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL22376514 0.93 PRKDC (0.42) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL22376511 0.92 PRKDC (0.41) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL26216347 0.92 CDC14B (0.39) CDC14BCDC14AALOX5MAPTALDH1A1
SCHEMBL25627795 0.92 PRKDC (0.40) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL22376498 0.92 PRKDC (0.36) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL25458008 0.92 ALOX5 (0.45) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL22375903 0.92 PRKDC (0.39) CDC14BCDC14AALOX5PRKDCPIK3CD
SCHEMBL22376497 0.92 ALOX5 (0.40) CDC14BCDC14AALOX5PRKDCPIK3CD

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-2021182834-A1 NOVEL COMPOUND AND ORGANIC LIGHT-EMITTING DEVICE USING SAME 주식회사 엘지화학 2021-09-16 WO disclosed