SCHEMBL27296774

SCHEMBL27296774

c1ccc(-c2ccc(N(c3ccc(-c4cccc(-c5ccc6ccccc6c5)c4)cc3)c3ccccc3-c3cccc4c3ccc3oc5ccccc5c34)cc2)cc1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 3/20 0.35
▸ PLA2G4A P47712 3/20 0.35
▸ PLA2G10 O15496 1/20 0.35
▸ ANO1 Q5XXA6 1/20 0.35
▸ PGR P06401 1/20 0.34
▸ CYP1A1 P04798 2/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ FYN P06241 1/20 0.32
▸ MAPK3 P27361 1/20 0.32
▸ AHR P35869 1/20 0.32
▸ PAX8 Q06710 1/20 0.32
▸ ABCG2 Q9UNQ0 1/20 0.32
▸ HSD17B1 P14061 2/20 0.32
▸ HSD17B2 P37059 2/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ ALDH1A1 P00352 2/20 0.32
▸ MAPT P10636 2/20 0.32
▸ CASP3 P42574 1/20 0.31
▸ SENP7 Q9BQF6 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
SCHEMBL27298168 0.94 HPGD (0.35) PLA2G2APLA2G4APLA2G10PGRCYP1A1
SCHEMBL25869562 0.94 ANO1 (0.35) PLA2G2APLA2G4APLA2G10ANO1PGR
SCHEMBL24539841 0.93 ANO1 (0.34) PLA2G2APLA2G4APLA2G10ANO1PGR
SCHEMBL23180924 0.92 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ANO1PGR
SCHEMBL24964701 0.92 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ANO1PGR
SCHEMBL26040065 0.92 ANO1 (0.34) PLA2G2APLA2G4APLA2G10ANO1PGR
SCHEMBL27297357 0.92 CA12 (0.36) PLA2G2APLA2G4APLA2G10CYP1A1CYP1A2
SCHEMBL25868906 0.92 TDP1 (0.37) PLA2G2APLA2G4APLA2G10PGRCYP1A1
SCHEMBL24964050 0.91 PLA2G2A (0.36) PLA2G2APLA2G4APLA2G10ANO1PGR
SCHEMBL24964067 0.91 ANO1 (0.35) PLA2G2APLA2G4APLA2G10ANO1PGR

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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