SCHEMBL27292064

SCHEMBL27292064

c1ccc(-c2c3ccccc3c(-c3ccc(-c4oc5c(ccc6oc7ccccc7c65)c4-c4ccccc4)cc3)c3ccccc23)cc1

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PLA2G2A P14555 1/20 0.42
▸ PLA2G4A P47712 1/20 0.42
▸ CA1 P00915 2/20 0.41
▸ CA2 P00918 2/20 0.41
▸ DDR2 Q16832 1/20 0.41
▸ PTGS2 P35354 3/20 0.39
▸ PTGS1 P23219 1/20 0.39
▸ CHRM2 P08172 1/20 0.39
▸ CHRM4 P08173 1/20 0.39
▸ CHRM5 P08912 1/20 0.39
▸ CHRM1 P11229 1/20 0.39
▸ CHRM3 P20309 1/20 0.39
▸ ALDH1A1 P00352 5/20 0.39
▸ ALOX15 P16050 2/20 0.39
▸ HSD17B10 Q99714 2/20 0.39
▸ ADORA2A P29274 1/20 0.39
▸ TNK2 Q07912 1/20 0.38
▸ MEN1 O00255 4/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ KDM4E B2RXH2 4/20 0.38

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
SCHEMBL27291985 0.93 CA1 (0.42) PLA2G2APLA2G4ACA1CA2DDR2
SCHEMBL27287156 0.85 ABCG2 (0.41) PLA2G2APLA2G4AALDH1A1HSD17B10KDM4E
SCHEMBL27287149 0.85 ABCG2 (0.37) PLA2G2APLA2G4ACA1CA2DDR2
SCHEMBL17944460 0.82 PLA2G2A (0.40) PLA2G2APLA2G4ACA1CA2ALDH1A1
SCHEMBL27327416 0.82 PLA2G2A (0.39) PLA2G2APLA2G4ACA1CA2DDR2
SCHEMBL27292061 0.82 LIPG (0.50) PLA2G2APLA2G4ACA1CA2DDR2
SCHEMBL17945576 0.81 PLA2G2A (0.46) PLA2G2APLA2G4ACA1CA2ALDH1A1
SCHEMBL17944084 0.81 AHR (0.41) PLA2G2APLA2G4ACA1CA2ALDH1A1
SCHEMBL17945028 0.81 AHR (0.41) PLA2G2APLA2G4ACA1CA2ALDH1A1
SCHEMBL17944478 0.81 PLA2G2A (0.43) PLA2G2APLA2G4ACA1CA2ALDH1A1

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-2024010167-A1 COMPOUND AND ORGANIC LIGHT-EMITTING ELEMENT COMPRISING SAME 주식회사 엘지화학 2024-01-11 — — WO disclosed
Send feedback