SCHEMBL11820175

SCHEMBL11820175

Cc1cc(Cc2ccccc2C)c(O)c(Cc2ccccc2C)c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
AMY1A P0DUB6 1/20 0.58
CYP2C9 P11712 2/20 0.52
CYP2C19 P33261 2/20 0.52
HIF1A Q16665 2/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
HSPA5 P11021 2/20 0.48
CNR2 P34972 2/20 0.48
GPR55 Q9Y2T6 1/20 0.48
CYP2D6 P10635 1/20 0.46
HSD17B10 Q99714 1/20 0.46
TAAR1 Q96RJ0 1/20 0.41
GABRA1 P14867 1/20 0.40
GABRB2 P47870 1/20 0.40
CA12 O43570 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CA7 P43166 1/20 0.40
CA9 Q16790 1/20 0.40
CA14 Q9ULX7 1/20 0.40
ALDH1A1 P00352 1/20 0.39

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
SCHEMBL3027866 1.00 AMY1A (0.58) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL9341585 0.86 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL20154792 0.86 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL30374717 0.86 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL3636408 0.86 AMY1A (0.45) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL1904809 0.84 AMY1A (0.58) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL29290539 0.84 AMY1A (0.69) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL30375225 0.84 AMY1A (0.69) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL7758427 0.84 AMY1A (0.69) AMY1ACYP2C9CYP2C19HIF1ASMN1; SMN2
SCHEMBL987106 0.82 AMY1A (0.56) AMY1ACYP2C9CYP2C19HIF1ASMN1; 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
US-3931060-A POLYURETHANE FOAM FREE FROM INTERNAL DISCOLORATION BAYER AKTIENGESELLSCHAFT (DT) 1976-01-06 US disclosed