SCHEMBL9847749

SCHEMBL9847749

Cc1cc(Oc2ccc(C#N)c(C#N)c2)c(C)c(C)c1Oc1ccc(C#N)c(C#N)c1

nearest known ligand 0.49

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AR P10275 15/20 0.49
CYP19A1 P11511 1/20 0.43

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
SCHEMBL1656725 0.83 AR (0.54) ARCYP19A1
SCHEMBL1655815 0.82 AR (0.68) ARCYP19A1
SCHEMBL8630217 0.80 AR (0.58) ARCYP19A1
SCHEMBL23795062 0.79 AR (0.55) ARCYP19A1
SCHEMBL522176 0.79 AR (0.68) ARCYP19A1
SCHEMBL20106821 0.78 AR (0.52) ARCYP19A1
SCHEMBL15268658 0.78 AR (0.75) ARCYP19A1
SCHEMBL8631303 0.76 AR (0.62) ARCYP19A1
SCHEMBL29390509 0.75 CYP19A1 (0.65) ARCYP19A1
SCHEMBL4581525 0.75 CYP19A1 (0.65) ARCYP19A1

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-0413415-A1 Carboxylic acids and derivates thereof The British Petroleum Company p.l.c. (GB) 1991-02-20 EP disclosed