SCHEMBL14760274

SCHEMBL14760274

CCCC(CCC)(c1ccc(O)cc1)c1ccc(O)cc1.CCCCCCC(c1cc(C)c(O)cc1C(C)(C)C)c1cc(C)c(O)cc1C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 19/20 0.46
ESR2 Q92731 5/20 0.46
AR P10275 1/20 0.46
TP53 P04637 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
ALOX15 P16050 1/20 0.41
CYP2C19 P33261 1/20 0.41

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
SCHEMBL1068244 0.86 ALOX15 (0.52) ESR1ESR2ARTP53CYP2D6
SCHEMBL31206030 0.75 ALOX15 (0.67) ESR1ESR2ARTP53CYP2D6
SCHEMBL1069000 0.75 ALOX15 (0.67) ESR1ESR2ARTP53CYP2D6
SCHEMBL224494 0.71 CYP2D6 (0.51) ESR1ESR2ARTP53CYP2D6
SCHEMBL9396698 0.71 ESR1 (0.79) ESR1ESR2ARTP53
SCHEMBL11188891 0.71 ESR1 (0.79) ESR1ESR2ARTP53
SCHEMBL11182155 0.71 ESR1 (0.79) ESR1ESR2ARTP53
SCHEMBL28255062 0.71 ESR1 (0.79) ESR1ESR2ARTP53
SCHEMBL5086034 0.71 ALOX15 (0.78) ESR1ESR2TP53CYP2D6CYP2C9
SCHEMBL5710085 0.71 ALOX15 (0.78) ESR1ESR2TP53CYP2D6CYP2C9

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
EP-2277936-B1 Method of preparing polycarbonate resin LG CHEMICAL LTD (KR) 2013-03-13 EP disclosed