SCHEMBL24930489

SCHEMBL24930489

c1ccc(-c2nc(-c3ccccc3)nc(-c3cccc4sc5cc(-c6ccc(-c7cccc8c7oc7ccccc78)c7oc8ccccc8c67)ccc5c34)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 2/20 0.41
BRDT Q58F21 1/20 0.35
GGPS1 O95749 1/20 0.34
PRKDC P78527 4/20 0.34
PTGES2 Q9H7Z7 1/20 0.34
PIK3CD O00329 1/20 0.33
PIK3CB P42338 1/20 0.33
MAPT P10636 4/20 0.32
ALDH1A1 P00352 3/20 0.31
TSHR P16473 2/20 0.31
POLB P06746 2/20 0.31
HPGD P15428 1/20 0.31
KDM4E B2RXH2 1/20 0.31
NPSR1 Q6W5P4 1/20 0.31
CDC14B O60729 1/20 0.31
CDC14A Q9UNH5 1/20 0.31
LMNA P02545 2/20 0.31
USP2 O75604 1/20 0.31
HSD17B10 Q99714 1/20 0.31
HTT P42858 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
SCHEMBL26217700 0.94 ALOX5 (0.37) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL26217803 0.94 ALOX5 (0.37) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL24929395 0.94 ALOX5 (0.40) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL24217075 0.94 ALOX5 (0.46) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL26220821 0.93 ALOX5 (0.37) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL26220857 0.93 ALOX5 (0.37) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL23349478 0.93 ALOX5 (0.39) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL24929516 0.93 ALOX5 (0.38) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL24930493 0.92 ALOX5 (0.37) ALOX5BRDTGGPS1PRKDCPTGES2
SCHEMBL26228194 0.92 ALOX5 (0.36) ALOX5BRDTGGPS1PRKDCPTGES2

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