SCHEMBL11948969

SCHEMBL11948969

CCC(C)C(=O)OCCCC(=O)OC1(C)C2CC3CC(C2)CC1C3

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 2/20 0.39
CYP19A1 P11511 2/20 0.39
EPHX2 P34913 18/20 0.36

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
SCHEMBL824227 0.92 CYP17A1 (0.40) CYP17A1CYP19A1EPHX2
SCHEMBL13231664 0.86 EPHX2 (0.35) EPHX2
SCHEMBL824232 0.84 CYP17A1 (0.41) CYP17A1CYP19A1EPHX2
SCHEMBL824307 0.84 CYP17A1 (0.38) CYP17A1CYP19A1
SCHEMBL13231690 0.82 EPHX2 (0.39) EPHX2
SCHEMBL110539 0.82 CYP17A1 (0.40) CYP17A1CYP19A1
SCHEMBL11946899 0.82 CYP17A1 (0.40) CYP17A1CYP19A1EPHX2
SCHEMBL11948972 0.80 EPHX2 (0.32) CYP17A1CYP19A1EPHX2
SCHEMBL824231 0.79 EPHX2 (0.32) EPHX2
SCHEMBL7964787 0.79 CYP17A1 (0.46) CYP17A1CYP19A1EPHX2

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