SCHEMBL11948972

SCHEMBL11948972

CCC(C)C(=O)OCCC(=O)OC1(C)C2CC3CC1CC(C)(C3)C2

nearest known ligand 0.32

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 3/20 0.32
CYP17A1 P05093 1/20 0.31
CYP19A1 P11511 1/20 0.31

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
SCHEMBL13231678 0.88 EPHX2 (0.31) EPHX2
SCHEMBL11948929 0.88 ALDH1A1 (0.36) EPHX2CYP17A1CYP19A1
SCHEMBL824227 0.87 CYP17A1 (0.40) EPHX2CYP17A1CYP19A1
SCHEMBL13231697 0.81 EPHX2 (0.34) EPHX2
SCHEMBL13231695 0.81 EPHX2 (0.38) EPHX2
SCHEMBL10136378 0.80 THRB (0.35) EPHX2CYP17A1CYP19A1
SCHEMBL11948969 0.80 CYP17A1 (0.39) EPHX2CYP17A1CYP19A1
SCHEMBL11948973 0.80 EPHX2 (0.32) EPHX2CYP17A1CYP19A1
SCHEMBL11948966 0.78 EPHX2 (0.32) EPHX2
SCHEMBL824231 0.77 EPHX2 (0.32) EPHX2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8232039-B2 Polymer and resist composition comprising the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-07-31 US disclosed
US-20100124719-A1 Polymer and Resist Composition Comprising the Same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2010-05-20 US disclosed