SCHEMBL25089441

SCHEMBL25089441

c1ccc(-c2ccc(-c3ccc(N(c4ccc(-c5cccc6c5ccc5ccccc56)cc4)c4ccccc4-c4cccc5c4oc4ccccc45)cc3)cc2)cc1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.40
▸ PRKDC P78527 5/20 0.34
▸ PIK3CD O00329 1/20 0.34
▸ PIK3CB P42338 1/20 0.34
▸ GGPS1 O95749 1/20 0.33
▸ CA12 O43570 2/20 0.32
▸ CA1 P00915 2/20 0.32
▸ CA2 P00918 2/20 0.32
▸ CA9 Q16790 2/20 0.32
▸ KDM4E B2RXH2 2/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ HPGD P15428 2/20 0.32
▸ TSHR P16473 2/20 0.32
▸ HSD17B10 Q99714 2/20 0.32
▸ ALOX15 P16050 1/20 0.32
▸ CASP1 P29466 1/20 0.32
▸ CASP7 P55210 1/20 0.32
▸ TNF P01375 1/20 0.32
▸ PTGES2 Q9H7Z7 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
SCHEMBL25089351 0.98 ALOX5 (0.40) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25089450 0.97 ALOX5 (0.39) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25088865 0.97 ALOX5 (0.41) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25089339 0.97 ALOX5 (0.41) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25089621 0.96 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25088282 0.96 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25089365 0.96 ALOX5 (0.40) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL25089337 0.95 ALOX5 (0.39) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL26063637 0.94 ALOX5 (0.43) ALOX5PRKDCPIK3CDPIK3CBGGPS1
SCHEMBL23232637 0.94 ALOX5 (0.42) ALOX5PRKDCPIK3CDPIK3CBGGPS1

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-2023027173-A1 COMPOUND, ORGANIC ELECTROLUMINESCENT ELEMENT MATERIAL, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-03-02 — — WO disclosed
Send feedback