SCHEMBL3021159

SCHEMBL3021159

CC(C)NS(=O)(=O)c1ccc(Br)c(F)c1

nearest known ligand 0.48

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
GFER P55789 1/20 0.46
HTR2B P41595 1/20 0.44
IDO1 P14902 1/20 0.44
KMT2A Q03164 1/20 0.44
PNMT P11086 1/20 0.42
SLC1A3 P43003 1/20 0.41
SLC1A2 P43004 1/20 0.41
SLC1A1 P43005 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
MMP1 P03956 1/20 0.40
MMP2 P08253 1/20 0.40
MMP3 P08254 1/20 0.40
MMP7 P09237 1/20 0.40
MMP9 P14780 1/20 0.40
MMP13 P45452 1/20 0.40

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
SCHEMBL30817631 1.00 ALDH1A1 (0.48) ALDH1A1GFERHTR2BIDO1KMT2A
SCHEMBL22718166 0.87 ALDH1A1 (0.48) ALDH1A1GFERHTR2BIDO1KMT2A
SCHEMBL21201450 0.81 ALDH1A1 (0.49) ALDH1A1GFERIDO1KMT2ANPSR1
SCHEMBL3017872 0.81 LMNA (0.49) ALDH1A1IDO1KMT2APNMT
SCHEMBL19156888 0.80 KMT2A (0.42) ALDH1A1IDO1KMT2ASLC1A3SLC1A2
SCHEMBL16872857 0.80 ALDH1A1 (0.59) ALDH1A1GFERKMT2APNMTNPSR1
SCHEMBL1368170 0.78 ALDH1A1 (0.49) ALDH1A1GFERKMT2APNMTNPSR1
SCHEMBL29130981 0.77 CA1 (0.47) ALDH1A1GFERIDO1KMT2A
SCHEMBL15794097 0.77 IDO1 (0.40) IDO1KMT2A
SCHEMBL31444289 0.77 IDO1 (0.44) ALDH1A1IDO1KMT2A

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 ALDH1A1 946/4885GFER 469/4885HTR2B 596/4885
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 ALDH1A1 1586/4885GFER 2530/4885HTR2B 1089/4885

“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.