SCHEMBL10169157

SCHEMBL10169157

C=CC(=O)OC12CC3CC(C1)CC(OC(=O)C(F)(F)F)(C3)C2

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SCN9A Q15858 1/20 0.33
CYP17A1 P05093 1/20 0.30
CYP19A1 P11511 1/20 0.30
MEN1 O00255 1/20 0.30
ALDH1A1 P00352 1/20 0.30
KMT2A Q03164 1/20 0.30

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
SCHEMBL822780 0.87 ALDH1A1 (0.36) CYP19A1MEN1ALDH1A1KMT2A
SCHEMBL29281840 0.82 MEN1 (0.30) MEN1ALDH1A1KMT2A
SCHEMBL10169153 0.82
SCHEMBL10169164 0.82 MEN1 (0.31) MEN1ALDH1A1KMT2A
SCHEMBL4857036 0.81
SCHEMBL6560570 0.80 DPP4 (0.37) MEN1ALDH1A1KMT2A
SCHEMBL19335366 0.80 CYP17A1 (0.37) SCN9ACYP17A1CYP19A1
SCHEMBL10211044 0.79 CYP19A1 (0.34) CYP17A1CYP19A1MEN1ALDH1A1KMT2A
SCHEMBL4105447 0.79 DPP8 (0.32) CYP17A1CYP19A1MEN1ALDH1A1KMT2A
SCHEMBL2610380 0.79

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9229320-B2 Resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-01-05 US disclosed
US-9229320-B2 Resist composition and method for producing resist pattern SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2016-01-05 US disclosed
US-20120034563-A1 RESIST COMPOSITION AND METHOD FOR PRODUCING RESIST PATTERN SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2012-02-09 US disclosed