SCHEMBL14035906

SCHEMBL14035906

O=C(OC12CC3CC(C1)C(O)C(C3)C2)C(F)(F)OOS

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 1/20 0.32
CYP19A1 P11511 1/20 0.32
TSHR P16473 1/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL14035930 0.82 TSHR (0.49) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL686054 0.80 CYP19A1 (0.39) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL685197 0.80 CYP19A1 (0.39) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL14035928 0.77 ALDH1A1 (0.36)
SCHEMBL2605932 0.77 TSHR (0.35) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL685199 0.77 CYP17A1 (0.38) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL2606034 0.77 CYP17A1 (0.31) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL12345922 0.76 CYP19A1 (0.41) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL14009493 0.75 CYP17A1 (0.32) CYP17A1CYP19A1TSHRNPSR1
SCHEMBL14035931 0.75 PKM (0.33)

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
US-20080274426-A1 Using acrylic ester and sulfonium said salt; high resolution semiconductors; microfabrication patterns; excimer laser lithography SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2008-11-06 US disclosed