SCHEMBL1631934

SCHEMBL1631934

CCOC(=O)c1ccc(-c2cn(C(C)C)c3cc(NS(C)(=O)=O)ccc23)cc1

nearest known ligand 0.63

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PGR P06401 8/20 0.63
NR3C1 P04150 7/20 0.63
NR3C2 P08235 7/20 0.63
AR P10275 6/20 0.59
HPGD P15428 2/20 0.56
RECQL P46063 1/20 0.56
SCN9A Q15858 3/20 0.47
SCN5A Q14524 2/20 0.47
F2RL3 Q96RI0 1/20 0.45
ALDH1A1 P00352 1/20 0.45
LMNA P02545 1/20 0.45
CA1 P00915 1/20 0.44
CA2 P00918 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.43
MMP2 P08253 1/20 0.42
MMP13 P45452 1/20 0.42
NHERF1 O14745 1/20 0.42

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
SCHEMBL1630745 0.90 PGR (0.67) PGRNR3C1NR3C2ARHPGD
SCHEMBL1630789 0.86 PGR (0.70) PGRNR3C1NR3C2ARHPGD
SCHEMBL1629963 0.85 PGR (0.69) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1630826 0.82 PGR (0.74) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1631048 0.80 PGR (0.74) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1631091 0.80 PGR (0.73) PGRNR3C1NR3C2ARHPGD
SCHEMBL1630275 0.80 PGR (0.62) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1629329 0.78 PGR (0.71) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1629465 0.78 PGR (0.71) PGRNR3C1NR3C2ARSCN9A
SCHEMBL1629927 0.78 PGR (0.71) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7932284-B2 Indole sulfonamide modulators of progesterone receptors ELI LILLY AND COMPANY (US) 2011-04-26 US disclosed