SCHEMBL1099598

SCHEMBL1099598

O=S(=O)(c1cccnc1)N(CCCC(F)(F)F)c1sc2ccccc2c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RORC P51449 2/20 0.41
TRPM8 Q7Z2W7 3/20 0.33
KEAP1 Q14145 2/20 0.32
NFE2L2 Q16236 2/20 0.32
ESR1 P03372 1/20 0.32
ESR2 Q92731 1/20 0.32
PTGER2 P43116 2/20 0.32
HTR1A P08908 1/20 0.31
DRD2 P14416 1/20 0.31
HTR2A P28223 1/20 0.31
HTR7 P34969 1/20 0.31
HTR6 P50406 1/20 0.31
MAPT P10636 1/20 0.31
CYP2D6 P10635 3/20 0.31
HRH1 P35367 3/20 0.31
CHRM1 P11229 2/20 0.31
CYP3A4 P08684 1/20 0.31
KCNH2 Q12809 1/20 0.31
NAPRT Q6XQN6 1/20 0.31
NR1H2 P55055 1/20 0.31

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
SCHEMBL1098086 0.89 RORC (0.42) RORCTRPM8KEAP1NFE2L2ESR1
SCHEMBL1100712 0.88 NR1I2 (0.39) RORCKEAP1NFE2L2ESR1CYP2D6
SCHEMBL1099577 0.82 RORC (0.48) RORCTRPM8KEAP1NFE2L2ESR1
SCHEMBL1099722 0.80 TRPM8 (0.51) TRPM8ESR1ESR2
SCHEMBL1099524 0.80 ESR1 (0.38) RORCTRPM8KEAP1NFE2L2ESR1
SCHEMBL1098734 0.79 TRPM8 (0.56) TRPM8
SCHEMBL1098518 0.79 RORC (0.41) RORCTRPM8KEAP1NFE2L2ESR1
SCHEMBL1100218 0.78 TRPM8 (0.57) RORCTRPM8MAPTMMP1MMP9
SCHEMBL1097497 0.78 TRPM8 (0.57) RORCTRPM8MAPTMMP1MMP9
SCHEMBL1098446 0.78 TRPM8 (0.44) RORCTRPM8PTGER2CYP3A4

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 RORC 3514/4885TRPM8 1/4885KEAP1 2521/4885
US-20140315899-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 RORC 3514/4885TRPM8 1/4885KEAP1 2521/4885
US-20090264474-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 RORC 3514/4885TRPM8 1/4885KEAP1 2521/4885

“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.