SCHEMBL24929419

SCHEMBL24929419

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4c3sc3ccc(-c5ccc(-c6cccc7c6oc6ccccc67)c6c5oc5ccccc56)cc34)n2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 3/20 0.42
GGPS1 O95749 1/20 0.36
PRKDC P78527 8/20 0.34
PIK3CD O00329 3/20 0.34
PIK3CB P42338 3/20 0.34
PTGES2 Q9H7Z7 1/20 0.34
CDC14B O60729 2/20 0.32
CDC14A Q9UNH5 2/20 0.32
BRD4 O60885 1/20 0.32
PIK3CA P42336 1/20 0.32
MTOR P42345 1/20 0.32
PIK3CG P48736 1/20 0.32
KCNH2 Q12809 1/20 0.32
BRDT Q58F21 1/20 0.32
MAPT P10636 2/20 0.31
ALDH1A1 P00352 2/20 0.31
HPGD P15428 1/20 0.31
TSHR P16473 1/20 0.31
KDM4E B2RXH2 1/20 0.31
POLB P06746 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
SCHEMBL24929423 0.97 ALOX5 (0.41) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL24217373 0.94 ALOX5 (0.47) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL24929664 0.93 ALOX5 (0.41) ALOX5PRKDCPIK3CDPIK3CBCDC14B
SCHEMBL23349535 0.93 ALOX5 (0.43) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL26240723 0.93 ALOX5 (0.37) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL26240687 0.93 ALOX5 (0.37) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL23349771 0.93 ALOX5 (0.46) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL24929532 0.92 ALOX5 (0.42) ALOX5GGPS1PRKDCPIK3CDPIK3CB
SCHEMBL26226315 0.92 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBCDC14B
SCHEMBL26219821 0.92 ALOX5 (0.37) ALOX5PRKDCPIK3CDPIK3CBCDC14B

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-2023008795-A1 HETEROCYCLIC COMPOUND, ORGANIC LIGHT-EMITTING DEVICE COMPRISING SAME, AND COMPOSITION FOR ORGANIC LAYER 엘티소재주식회사 2023-02-02 WO disclosed