SCHEMBL25640491

SCHEMBL25640491

c1ccc(-c2ccccc2N(c2ccc(-c3cccc4c3oc3ccccc34)cc2)c2ccc3c(c2)sc2ccc4c(oc5ccc6ccccc6c54)c23)cc1

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.36
▸ PTGES2 Q9H7Z7 1/20 0.31
▸ PRKDC P78527 1/20 0.31
▸ GGPS1 O95749 1/20 0.31
▸ CYP1A1 P04798 1/20 0.31
▸ CYP1A2 P05177 1/20 0.31
▸ FYN P06241 1/20 0.31
▸ MAPK3 P27361 1/20 0.31
▸ AHR P35869 1/20 0.31
▸ PAX8 Q06710 1/20 0.31
▸ ABCG2 Q9UNQ0 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
SCHEMBL25640043 0.96 ALOX5 (0.36) ALOX5PTGES2PRKDCGGPS1CYP1A1
SCHEMBL25640633 0.95 ALOX5 (0.36) ALOX5PTGES2PRKDCGGPS1CYP1A1
SCHEMBL25640499 0.93 ALOX5 (0.39) ALOX5PTGES2PRKDCGGPS1CYP1A1
SCHEMBL25640562 0.91 ALOX5 (0.36) ALOX5PTGES2PRKDCGGPS1
SCHEMBL25640520 0.91 ALOX5 (0.36) ALOX5PTGES2PRKDCGGPS1CYP1A1
SCHEMBL25640493 0.91 ALOX5 (0.31) ALOX5
SCHEMBL25640711 0.90 ALOX5 (0.35) ALOX5PTGES2PRKDC
SCHEMBL25640388 0.90 ALOX5 (0.36) ALOX5PTGES2PRKDCGGPS1CYP1A1
SCHEMBL25886084 0.89 ALOX5 (0.39) ALOX5PTGES2PRKDCGGPS1CYP1A1
SCHEMBL25885714 0.89 ALOX5 (0.40) ALOX5PTGES2PRKDCGGPS1CYP1A1

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-2023113334-A1 COMPOUND FOR ORGANIC OPTOELECTRONIC DIODE, COMPOSITION FOR ORGANIC OPTOELECTRONIC DIODE, ORGANIC OPTOELECTRONIC DIODE, AND DISPLAY DEVICE 삼성에스디아이 주식회사 2023-06-22 — — WO disclosed
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