SCHEMBL25868661

SCHEMBL25868661

c1ccc(-c2ccccc2N(c2ccc(-c3cccc4ccccc34)cc2)c2ccc3ccc4oc5ccccc5c4c3c2)cc1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ABCG2 Q9UNQ0 4/20 0.36
▸ CYP1A1 P04798 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ FYN P06241 1/20 0.36
▸ MAPK3 P27361 1/20 0.36
▸ AHR P35869 1/20 0.36
▸ PAX8 Q06710 1/20 0.36
▸ MCL1 Q07820 1/20 0.35
▸ ACMSD Q8TDX5 1/20 0.35
▸ CA12 O43570 2/20 0.34
▸ CA1 P00915 2/20 0.34
▸ CA2 P00918 2/20 0.34
▸ CA9 Q16790 2/20 0.34
▸ MAPT P10636 4/20 0.34
▸ ALDH1A1 P00352 3/20 0.34
▸ KDM4E B2RXH2 3/20 0.34
▸ HPGD P15428 3/20 0.34
▸ TSHR P16473 3/20 0.34
▸ HSD17B10 Q99714 3/20 0.34
▸ ALOX15 P16050 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
SCHEMBL27297077 0.94 CA12 (0.36) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25868667 0.94 CA12 (0.39) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25868459 0.94 ABCG2 (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25868672 0.94 ABCG2 (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25516247 0.94 ABCG2 (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25868990 0.94 TDP1 (0.37) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25870444 0.93 TDP1 (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26490506 0.93 TDP1 (0.35) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL26040330 0.93 MCL1 (0.34) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL24656867 0.93 ABCG2 (0.36) ABCG2CYP1A1CYP1A2FYNMAPK3

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-2023132694-A1 ORGANIC LIGHT-EMITTING DEVICE 주식회사 엘지화학 2023-07-13 — — WO disclosed
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