SCHEMBL4660455

SCHEMBL4660455

CCS(=O)(=O)Nc1ccc(-c2cc(C(C)(C)C)c(C#N)n2C(=O)O)cc1

nearest known ligand 0.49

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PGR P06401 9/20 0.49
HPGD P15428 5/20 0.39
LMNA P02545 2/20 0.39
NR3C2 P08235 1/20 0.39
KIF11 P52732 1/20 0.39
AR P10275 2/20 0.36
NR1H2 P55055 1/20 0.36
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
FKBP4 Q02790 1/20 0.35
FKBP5 Q13451 1/20 0.35

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
SCHEMBL4599336 0.77 PGR (0.69) PGRHPGDLMNAAR
SCHEMBL4790986 0.70 PGR (0.61) PGRHPGDKIF11ARNR1H2
SCHEMBL4599337 0.69 HPGD (0.51) PGRHPGDLMNANR3C2KIF11
SCHEMBL4611480 0.66 PGR (1.00) PGRAR
SCHEMBL6727738 0.66 PGR (0.58) PGRHPGDLMNANR3C2KIF11
SCHEMBL5132601 0.65 PGR (0.74) PGRHPGDLMNAKIF11AR
SCHEMBL4612707 0.65 PGR (0.67) PGRHPGDLMNAKIF11AR
SCHEMBL4598912 0.64 PGR (0.74) PGRHPGDLMNAKIF11AR
SCHEMBL5344146 0.64 NR1H2 (0.45) PGRHPGDLMNANR3C2KIF11
SCHEMBL28549758 0.64 CA1 (0.61) PGRHPGDLMNANR3C2KIF11

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1910285-A1 CYANOPYRROLE-SULFONAMIDE PROGESTERONE RECEPTOR MODULATORS AND USES THEREOF Wyeth a Corporation of the State of Delaware (US) 2008-04-16 EP disclosed
US-7291643-B2 Cyanopyrrole-sulfonamide progesterone receptor modulators and uses thereof WYETH (US) 2007-11-06 US disclosed
WO-2007016212-A1 CYANOPYRROLE-SULFONAMIDE PROGESTERONE RECEPTOR MODULATORS AND USES THEREOF WYETH (US) 2007-02-08 WO disclosed
US-20070027201-A1 Use of progesterone receptor modulators WYETH (US) 2007-02-01 US disclosed
US-20070027126-A1 E.g., N-[4-(5-cyano-1-methyl-1H-pyrrol-2-yl)phenyl]propane-1-sulfonamide and tert-butyl 2-cyano-5-{4-{(ethylsulfonyl)amino]phenyl}-1H-pyrrole-1-carboxylate; useful for contraception and hormone replacement therapy WYETH (US) 2007-02-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070027201-A1 Use of progesterone receptor modulators GNRHR, PGR, FSHR PGR 2/4885HPGD 358/4885LMNA 1341/4885
US-20070027126-A1 E.g., N-[4-(5-cyano-1-methyl-1H-pyrrol-2-yl)phenyl]propane-1-sulfonamide and tert-butyl 2-cyano-5-{4-{(ethylsulfonyl)amino]phenyl}-1H-pyrrole-1-carboxylate; useful for contraception and hormone replacement therapy GNRHR, PGR, PRLHR PGR 2/4885HPGD 736/4885LMNA 3177/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.