SCHEMBL14644147

SCHEMBL14644147

CBc1cccc(-c2ccc3c4ccccc4c4ccccc4c3c2)c1

nearest known ligand 0.33

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ TRIM58 Q8NG06 1/20 0.33
▸ MAP4K4 O95819 3/20 0.32
▸ TNKS2 Q9H2K2 1/20 0.31
▸ PLA2G10 O15496 1/20 0.30
▸ PLA2G2A P14555 1/20 0.30
▸ PLA2G4A P47712 1/20 0.30
▸ HSD17B1 P14061 2/20 0.30
▸ HSD17B2 P37059 2/20 0.30
▸ ESR1 P03372 2/20 0.30
▸ CYP3A4 P08684 1/20 0.30
▸ CYP2C9 P11712 1/20 0.30
▸ MEN1 O00255 1/20 0.30
▸ KMT2A Q03164 1/20 0.30
▸ ESR2 Q92731 1/20 0.30

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
SCHEMBL14644808 0.84 TRIM58 (0.38) TRIM58MAP4K4TNKS2CYP3A4MEN1
SCHEMBL20319075 0.81 MAOA (0.44) HSD17B1HSD17B2ESR1CYP3A4CYP2C9
SCHEMBL19041601 0.81 HSD17B1 (0.34) MAP4K4PLA2G10PLA2G2APLA2G4AHSD17B1
SCHEMBL22247689 0.79 ESR1 (0.38) MAP4K4PLA2G10PLA2G2APLA2G4AHSD17B1
SCHEMBL20870670 0.79 HPRT1 (0.36) —
SCHEMBL311937 0.79 ESR1 (0.46) PLA2G10PLA2G2APLA2G4AHSD17B1HSD17B2
SCHEMBL311659 0.79 ESR1 (0.46) PLA2G10PLA2G2APLA2G4AHSD17B1HSD17B2
SCHEMBL4133589 0.76 HPRT1 (0.45) MAP4K4TNKS2PLA2G2APLA2G4ACYP2C9
SCHEMBL23432303 0.74 MEN1 (0.48) MAP4K4PLA2G10PLA2G2APLA2G4AHSD17B1
SCHEMBL20431790 0.74 MEN1 (0.48) MAP4K4PLA2G10PLA2G2APLA2G4AHSD17B1

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-2013009013-A2 NOVEL COMPOUND AND ORGANIC ELECTRONIC DEVICE USING SAME 주식회사 엘지화학 (KR) 2013-01-17 — — WO disclosed
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