SCHEMBL1099451

SCHEMBL1099451

CCCCN(c1sc2ccccc2c1Br)S(=O)(=O)NC

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ESR1 P03372 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.35
TDP1 Q9NUW8 1/20 0.34
PTGS2 P35354 2/20 0.34
NR1I2 O75469 1/20 0.34
ALOX5 P09917 1/20 0.33
PTPN1 P18031 1/20 0.33
CNR2 P34972 2/20 0.32
CNR1 P21554 1/20 0.32
MAPK1 P28482 1/20 0.32
HTT P42858 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 2/20 0.31
ALDH1A1 P00352 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
THRB P10828 1/20 0.31
HPGD P15428 1/20 0.30
GAA P10253 1/20 0.30

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
SCHEMBL1099605 0.88 RECQL (0.36) ESR1L3MBTL1TDP1PTGS2PTPN1
SCHEMBL1098743 0.87 PTPN1 (0.38) ESR1L3MBTL1TDP1PTGS2NR1I2
SCHEMBL1099204 0.85 MAPT (0.40) ESR1L3MBTL1TDP1NR1I2SMN1; SMN2
SCHEMBL1099029 0.84 TSHR (0.36) ESR1L3MBTL1TDP1PTGS2NR1I2
SCHEMBL1098503 0.83 TDP1 (0.49) ESR1L3MBTL1TDP1NR1I2ALOX5
SCHEMBL1098270 0.79 ALOX5 (0.44) ESR1L3MBTL1TDP1NR1I2ALOX5
SCHEMBL1099193 0.78 ESR1 (0.46) ESR1L3MBTL1TDP1NR1I2ALOX5
SCHEMBL1099163 0.77 ALOX5 (0.57) ESR1L3MBTL1TDP1NR1I2ALOX5
SCHEMBL1100712 0.77 NR1I2 (0.39) ESR1L3MBTL1TDP1NR1I2CYP2C9
SCHEMBL1098410 0.77 L3MBTL1 (0.60) ESR1L3MBTL1ALOX5CNR2ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9434711-B2 Sulfonamides as TRPM8 modulators JANSSEN PHARMACEUTICA, N.V. (BE) 2016-09-06 US disclosed
US-20140315899-A1 SULFONAMIDES AS TRPM8 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2014-10-23 US disclosed
US-8809327-B2 Sulfonamides as TRPM8 modulators JANSSEN PHARMACEUTICA, NV (BE) 2014-08-19 US disclosed
EP-2183239-B1 SULFONAMIDES AS TRPM8 MODULATORS JANSSEN PHARMACEUTICA NV (BE) 2012-08-22 EP disclosed
US-20120190674-A1 SULFONAMIDES AS TRPM8 MODULATORS BRANUM SHAWN T (US) 2012-07-26 US disclosed
US-8153682-B2 Sulfonamides as TRPM8 modulators JANSSEN PHARMACEUTICA, NV (BE) 2012-04-10 US disclosed
US-20090264474-A1 SULFONAMIDES AS TRPM8 MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2009-10-22 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 (3 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-20120190674-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 ESR1 1247/4885L3MBTL1 3261/4885TDP1 3703/4885
US-20140315899-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 ESR1 1247/4885L3MBTL1 3261/4885TDP1 3703/4885
US-20090264474-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 ESR1 1247/4885L3MBTL1 3261/4885TDP1 3703/4885

“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.