SCHEMBL14084591

SCHEMBL14084591

CCN(CC)S(=O)(=O)c1ccc(-c2ccc(N)n2C)cc1OC(F)(F)F

nearest known ligand 0.45

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.45
KDM4E B2RXH2 1/20 0.37
KMT2A Q03164 2/20 0.36
MEN1 O00255 1/20 0.36
ALDH1A1 P00352 1/20 0.36
PTPN1 P18031 1/20 0.35
POLB P06746 2/20 0.35
SCN9A Q15858 2/20 0.35
TSHR P16473 1/20 0.34
ALOX5AP P20292 4/20 0.34
FEN1 P39748 4/20 0.34
LMNA P02545 1/20 0.33
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
GAA P10253 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
PTGDR2 Q9Y5Y4 1/20 0.33
HIF1A Q16665 1/20 0.33
EPAS1 Q99814 1/20 0.33

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
SCHEMBL14083656 0.88 PGR (0.42) PGRKMT2AMEN1ALDH1A1PTPN1
SCHEMBL3027079 0.84 PGR (0.64) PGR
SCHEMBL14083654 0.81 PGR (0.46) PGRALDH1A1POLBTSHRHTT
SCHEMBL14084307 0.78 PGR (0.42) PGRKDM4EALOX5APFEN1
SCHEMBL3015009 0.74 TSHR (0.58) KDM4EKMT2AMEN1ALDH1A1PTPN1
SCHEMBL3012117 0.72 PGR (0.62) PGR
SCHEMBL3020619 0.69 PGR (0.64) PGR
SCHEMBL14084587 0.68 CA12 (0.44)
SCHEMBL3021308 0.67 PGR (0.67) PGR
SCHEMBL3025928 0.67 PGR (0.49) PGR

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
WO-2008109055-A2 CYANOPYRROLE SULFONAMIDES USEFUL FOR MODULATION OF THE PROGESTERONE RECEPTOR WYETH (US) 2008-09-12 WO disclosed