SCHEMBL1630776

SCHEMBL1630776

CC(C)n1cc(-c2cccc(C#N)c2)c2ccc(NS(C)(=O)=O)cc21

nearest known ligand 0.79

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PGR P06401 8/20 0.79
NR3C1 P04150 7/20 0.79
NR3C2 P08235 7/20 0.79
AR P10275 6/20 0.70
SCN9A Q15858 1/20 0.47
BRD4 O60885 9/20 0.43
IMPDH2 P12268 1/20 0.39
BRD1 O95696 1/20 0.39
BRPF1 P55201 1/20 0.39

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
SCHEMBL1632037 0.88 PGR (1.00) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1630550 0.86 PGR (0.78) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1629636 0.85 PGR (0.66) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1631091 0.84 PGR (0.73) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1630553 0.84 PGR (0.64) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1630707 0.83 PGR (0.76) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1631780 0.82 PGR (1.00) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1629393 0.82 PGR (0.78) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1630932 0.82 PGR (0.65) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1630207 0.82 PGR (0.61) PGRNR3C1NR3C2ARSCN9A

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-1979314-B1 INDOLE SULFONAMIDE MODULATORS OF PROGESTERONE RECEPTORS LILLY CO ELI (US) 2013-01-09 EP disclosed
US-7932284-B2 Indole sulfonamide modulators of progesterone receptors ELI LILLY AND COMPANY (US) 2011-04-26 US disclosed