SCHEMBL28074255

SCHEMBL28074255

CCc1cc(C(C)(C)C)cc(Cc2cc(C)ccc2O)c1O

nearest known ligand 0.66

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.66
CYP2C19 P33261 4/20 0.47
CYP2C9 P11712 3/20 0.47
HIF1A Q16665 3/20 0.47
SMN1; SMN2 Q16637 1/20 0.47
ESR1 P03372 3/20 0.45
ESR2 Q92731 3/20 0.45
HSPA5 P11021 2/20 0.45
CYP2D6 P10635 3/20 0.42
HSD17B2 P37059 2/20 0.41
HSD17B10 Q99714 1/20 0.40
HTT P42858 1/20 0.38
KLF10 Q13118 1/20 0.38
ANO1 Q5XXA6 1/20 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
SCHEMBL14681012 0.89 ESR1 (0.53) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL22500379 0.88 AMY1A (0.65) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL6452850 0.85 HSPA5 (0.61) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL4057184 0.84 AMY1A (0.74) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL30578945 0.84 AMY1A (0.62) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL12910311 0.83 CYP2C19 (0.56) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL1345527 0.82 CYP2D6 (0.59) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL3819212 0.82 CYP2D6 (0.59) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL1345705 0.82 CYP2D6 (0.59) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2
SCHEMBL3810884 0.82 CYP2D6 (0.59) AMY1ACYP2C19CYP2C9HIF1ASMN1; SMN2

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
CN-102526994-B Multi-piece golf balls including low hardness gradient cores 阿库施耐特公司 2016-06-08 CN disclosed