SCHEMBL27315368

SCHEMBL27315368

c1ccc(-c2cccc(-c3ccc(N(c4ccc(-c5ccc6c(c5)oc5ccccc56)cc4)c4ccccc4-c4ccc5oc6c7ccccc7ccc6c5c4)cc3)c2)cc1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 2/20 0.38
▸ PRKDC P78527 2/20 0.36
▸ PLA2G2A P14555 3/20 0.35
▸ PLA2G4A P47712 3/20 0.35
▸ PLA2G10 O15496 1/20 0.35
▸ CYP1A1 P04798 5/20 0.34
▸ CYP1A2 P05177 5/20 0.34
▸ CYP1B1 Q16678 5/20 0.34
▸ KDM4E B2RXH2 2/20 0.34
▸ ALDH1A1 P00352 2/20 0.34
▸ MAPT P10636 2/20 0.34
▸ HPGD P15428 2/20 0.34
▸ TSHR P16473 2/20 0.34
▸ HSD17B10 Q99714 2/20 0.34
▸ ABCC1 P33527 2/20 0.34
▸ ABCG2 Q9UNQ0 2/20 0.34
▸ MAPK1 P28482 2/20 0.34
▸ PDE5A O76074 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ ABCB1 P08183 1/20 0.34

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
SCHEMBL27315256 0.98 ALOX5 (0.37) ALOX5PRKDCPLA2G2APLA2G4ACYP1A1
SCHEMBL27315127 0.95 ALOX5 (0.39) ALOX5PRKDCPLA2G2APLA2G4APLA2G10
SCHEMBL27297840 0.95 ALOX5 (0.39) ALOX5PRKDCCYP1A1CYP1A2CYP1B1
SCHEMBL27301312 0.95 CYP1A1 (0.38) ALOX5PRKDCPLA2G2APLA2G4APLA2G10
SCHEMBL27314840 0.94 ALOX5 (0.37) ALOX5PRKDCPLA2G2APLA2G4APLA2G10
SCHEMBL27327188 0.94 ALOX5 (0.43) ALOX5PRKDCCYP1A1CYP1A2CYP1B1
SCHEMBL27334155 0.94 ALOX5 (0.38) ALOX5PRKDCPLA2G2APLA2G4APLA2G10
SCHEMBL27328140 0.94 ALOX5 (0.37) ALOX5PRKDCCYP1A1CYP1A2CYP1B1
SCHEMBL27326679 0.94 ALOX5 (0.37) ALOX5PRKDCCYP1A1CYP1A2CYP1B1
SCHEMBL27298016 0.94 CYP1A1 (0.38) ALOX5PRKDCCYP1A1CYP1A2CYP1B1

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-2023199832-A1 COMPOUND, MATERIAL FOR ORGANIC ELECTROLUMINESCENT ELEMENTS, ORGANIC ELECTROLUMINESCENT ELEMENT, AND ELECTRONIC DEVICE 出光興産株式会社 2023-10-19 — — WO disclosed
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