SCHEMBL25847429

SCHEMBL25847429

c1ccc(-c2ccc3ccc(-c4nc(-c5ccc6oc7ccc8ccccc8c7c6c5)nc(-c5cccc6oc7ccccc7c56)n4)cc3c2)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ABCG2 Q9UNQ0 4/20 0.39
CYP1A1 P04798 1/20 0.39
CYP1A2 P05177 1/20 0.39
FYN P06241 1/20 0.39
MAPK3 P27361 1/20 0.39
AHR P35869 1/20 0.39
PAX8 Q06710 1/20 0.39
PLA2G2A P14555 3/20 0.38
PLA2G4A P47712 3/20 0.38
PLA2G10 O15496 1/20 0.37
ALDH1A1 P00352 3/20 0.37
MAPT P10636 3/20 0.37
KDM4E B2RXH2 2/20 0.37
HPGD P15428 2/20 0.37
TSHR P16473 2/20 0.37
HSD17B10 Q99714 2/20 0.37
ESR1 P03372 1/20 0.37
ESR2 Q92731 1/20 0.37
ALOX15 P16050 1/20 0.37
CASP1 P29466 1/20 0.37

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
SCHEMBL25460165 0.95 PLA2G2A (0.39) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25501596 0.95 PLA2G2A (0.40) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL23820124 0.94 ABCG2 (0.40) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25502927 0.94 PLA2G2A (0.39) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL23821624 0.94 PLA2G2A (0.40) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL23821641 0.93 ALDH1A1 (0.40) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL23821923 0.93 PLA2G2A (0.38) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25503309 0.93 PGR (0.38) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL25008989 0.93 ALDH1A1 (0.38) ABCG2CYP1A1CYP1A2FYNMAPK3
SCHEMBL23820349 0.93 PLA2G2A (0.41) 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