SCHEMBL25089613

SCHEMBL25089613

c1ccc(-c2ccc(N(c3ccc(-c4cccc5c4oc4ccccc45)cc3)c3ccc(-c4cccc5c4ccc4ccccc45)c4ccccc34)cc2)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.42
▸ PRKDC P78527 6/20 0.35
▸ GGPS1 O95749 1/20 0.35
▸ CDC14B O60729 2/20 0.33
▸ CDC14A Q9UNH5 2/20 0.33
▸ PTGES2 Q9H7Z7 1/20 0.33
▸ PIK3CD O00329 2/20 0.31
▸ PIK3CB P42338 2/20 0.31
▸ ALDH1A1 P00352 3/20 0.31
▸ HPGD P15428 3/20 0.31
▸ KDM4E B2RXH2 2/20 0.31
▸ MAPT P10636 2/20 0.31
▸ TSHR P16473 2/20 0.31
▸ HSD17B10 Q99714 2/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ CASP1 P29466 1/20 0.31
▸ CASP7 P55210 1/20 0.31
▸ CYP1A2 P05177 3/20 0.30
▸ CYP1A1 P04798 2/20 0.30
▸ CYP1B1 Q16678 2/20 0.30

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
SCHEMBL18383218 0.96 ALOX5 (0.43) ALOX5PRKDCGGPS1CDC14BCDC14A
SCHEMBL20623865 0.93 ALOX5 (0.45) ALOX5PRKDCGGPS1CDC14BCDC14A
SCHEMBL25089621 0.92 ALOX5 (0.43) ALOX5PRKDCGGPS1CDC14BCDC14A
SCHEMBL25088282 0.92 ALOX5 (0.43) ALOX5PRKDCGGPS1CDC14BCDC14A
SCHEMBL17081220 0.92 ALOX5 (0.46) ALOX5PRKDCGGPS1PTGES2PIK3CD
SCHEMBL20435190 0.92 ALOX5 (0.40) ALOX5PRKDCGGPS1CDC14BCDC14A
SCHEMBL26055793 0.91 ALOX5 (0.44) ALOX5PRKDCGGPS1PTGES2ALDH1A1
SCHEMBL22432056 0.91 ALOX5 (0.43) ALOX5PRKDCGGPS1PTGES2PIK3CD
SCHEMBL25088231 0.91 ALOX5 (0.45) ALOX5PRKDCGGPS1PTGES2PIK3CD
SCHEMBL18540426 0.91 ALOX5 (0.47) ALOX5PRKDCGGPS1CDC14BCDC14A

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
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