SCHEMBL526524

SCHEMBL526524

COc1cc(NS(=O)(=O)c2cccc(F)c2F)ccc1-c1cnccc1C

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CYP17A1 P05093 17/20 0.65
ALPL P05186 3/20 0.47

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
SCHEMBL527505 0.86 CYP17A1 (0.71) CYP17A1ALPL
SCHEMBL526947 0.85 CYP17A1 (0.66) CYP17A1ALPL
SCHEMBL526359 0.83 CYP17A1 (0.66) CYP17A1
SCHEMBL527545 0.82 CYP17A1 (0.67) CYP17A1
SCHEMBL527237 0.81 CYP17A1 (0.70) CYP17A1ALPL
SCHEMBL527272 0.81 CYP17A1 (0.70) CYP17A1
SCHEMBL526211 0.81 CYP17A1 (0.70) CYP17A1ALPL
SCHEMBL527191 0.81 CYP17A1 (0.70) CYP17A1
SCHEMBL526745 0.81 CYP17A1 (0.70) CYP17A1ALPL
SCHEMBL527242 0.81 CYP17A1 (0.73) CYP17A1

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
EP-2598481-A1 SULFONAMIDE COMPOUNDS USEFUL AS CYP17 INHIBITORS Bristol-Myers Squibb Company (US) 2013-06-05 EP disclosed
WO-2012015723-A1 SULFONAMIDE COMPOUNDS USEFUL AS CYP17 INHIBITORS BRISTOL-MYERS SQUIBB COMPANY (US) 2012-02-02 WO disclosed