SCHEMBL1098683

SCHEMBL1098683

CCS(=O)(=O)N(CCOC(C)(C)C)c1sc2ccccc2c1Br

nearest known ligand 0.32

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.32
HPGD P15428 2/20 0.32
TSHR P16473 2/20 0.32
KDM4E B2RXH2 1/20 0.32
ALK Q9UM73 1/20 0.31
PTGS2 P35354 2/20 0.30
TRPM8 Q7Z2W7 1/20 0.30
NPC1 O15118 1/20 0.30
LMNA P02545 1/20 0.30
GLA P06280 1/20 0.30
MAPT P10636 1/20 0.30
ALOX15 P16050 1/20 0.30
ALOX12 P18054 1/20 0.30
RAB9A P51151 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
SCHEMBL1099924 0.87 TSHR (0.33) ALDH1A1TSHRPTGS2MAPT
SCHEMBL1099356 0.87 TRPM8 (0.40) ALDH1A1HPGDTSHRKDM4EALK
SCHEMBL1099718 0.86 TRPM8 (0.38) KDM4EPTGS2TRPM8
SCHEMBL1098116 0.83 ALDH1A1 (0.36) ALDH1A1HPGDTSHRKDM4ETRPM8
SCHEMBL1098743 0.83 PTPN1 (0.38) ALDH1A1HPGDTSHRPTGS2NPC1
SCHEMBL1099838 0.82 SLC6A9 (0.33) ALDH1A1HPGDTSHRKDM4ETRPM8
SCHEMBL1099476 0.80 TRPM8 (0.50) TRPM8RAB9A
SCHEMBL1099500 0.76 TRPM8 (0.41) ALDH1A1HPGDTSHRKDM4ETRPM8
SCHEMBL1099466 0.76 HDAC6 (0.33) ALDH1A1HPGDTSHRPTGS2TRPM8
SCHEMBL1097999 0.75 HSD11B1 (0.32) ALDH1A1HPGDTSHRPTGS2TRPM8

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 8 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
CN-101801949-A Sulfonamides as TRPM8 modulators JANSSEN PHARMACEUTICA NV 2010-08-11 CN 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 ALDH1A1 3091/4885HPGD 2923/4885TSHR 1373/4885
US-20140315899-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 ALDH1A1 3091/4885HPGD 2923/4885TSHR 1373/4885
US-20090264474-A1 SULFONAMIDES AS TRPM8 MODULATORS TRPM8, TRPM5, TRPM2 ALDH1A1 3091/4885HPGD 2923/4885TSHR 1373/4885

“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.