SCHEMBL3017809

SCHEMBL3017809

CCNS(=O)(=O)c1ccc(Br)cc1OC(F)(F)F

nearest known ligand 0.58

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
GLA P06280 1/20 0.58
SMN1; SMN2 Q16637 1/20 0.58
ALPL P05186 2/20 0.55
LMNA P02545 1/20 0.50
MCHR1 Q99705 9/20 0.48
ADRA2A P08913 8/20 0.48
NPY5R Q15761 8/20 0.48
PPARG P37231 2/20 0.46
CNR1 P21554 1/20 0.44
CNR2 P34972 1/20 0.44
CHRM2 P08172 1/20 0.43
CHRM1 P11229 1/20 0.43
RRM1 P23921 1/20 0.43
RRM2B Q7LG56 1/20 0.43
PTPN1 P18031 1/20 0.43
CA1 P00915 1/20 0.43
CA2 P00918 1/20 0.43

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
SCHEMBL3023079 0.89 ALPL (0.53) GLASMN1; SMN2ALPLLMNAMCHR1
SCHEMBL6034599 0.84 GAA (0.59) GLASMN1; SMN2ALPLLMNAMCHR1
SCHEMBL3018907 0.84 ALPL (0.58) ALPLMCHR1ADRA2ANPY5RPPARG
SCHEMBL6034094 0.84 ALPL (0.53) ALPLLMNAMCHR1ADRA2ANPY5R
SCHEMBL3019244 0.83 ALPL (0.57) ALPLLMNAMCHR1ADRA2ANPY5R
SCHEMBL3022960 0.82 MCHR1 (0.68) ALPLMCHR1ADRA2ANPY5RCNR1
SCHEMBL2005429 0.81 ALPL (0.50) ALPLLMNAMCHR1ADRA2ANPY5R
SCHEMBL3019250 0.81 ALPL (0.55) ALPLMCHR1ADRA2ANPY5RPPARG
SCHEMBL1023819 0.79 ALPL (0.52) ALPLMCHR1ADRA2ANPY5RPPARG
SCHEMBL2653076 0.79 ALPL (0.52) ALPLMCHR1ADRA2ANPY5RPPARG

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
US-20100204228-A1 Aryl Sulfonamides Useful for Modulation of the Progesterone Receptor WYETH LLC (US) 2010-08-12 US disclosed
US-7723332-B2 Aryl sulfonamides useful for modulation of the progesterone receptor WYETH LLC (US) 2010-05-25 US disclosed
EP-2137145-A2 CYANOPYRROL SULFONAMIDES USEFUL FOR MODULATION OF THE PROGESTERONE RECEPTOR Wyeth (US) 2009-12-30 EP disclosed
WO-2008109055-A2 CYANOPYRROLE SULFONAMIDES USEFUL FOR MODULATION OF THE PROGESTERONE RECEPTOR WYETH (US) 2008-09-12 WO disclosed
US-20080221201-A1 4-(5-cyano-1-methyl-1H-pyrrol-2-yl)-N-methylbenzenesulfonamide; contraception, treating or preventing fibroids, uterine leiomyomata, endometriosis, dysfunctional bleeding, polycystic ovary syndrome, or hormone-dependent carcinomas, providing hormone replacement therapy, stimulating food intake WYETH (US) 2008-09-11 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-20100204228-A1 Aryl Sulfonamides Useful for Modulation of the Progesterone Receptor FSHR, GNRHR, CYP19A1 GLA 3314/4885SMN1; SMN2 2785/4885ALPL 4718/4885
US-20080221201-A1 4-(5-cyano-1-methyl-1H-pyrrol-2-yl)-N-methylbenzenesulfonamide; contraception, treating or preventing fibroids, uterine leiomyomata, endometriosis, dysfunctional bleeding, polycystic ovary syndrome, or hormone-dependent carcinomas, providing hormone replacement therapy, stimulating food intake PKD1, PKD2, SHBG GLA 3622/4885SMN1; SMN2 3864/4885ALPL 4673/4885

“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.