SCHEMBL16894195

SCHEMBL16894195

CC(C)N(CC(=O)NCc1cccc(Br)c1)S(=O)(=O)c1ccc(F)cc1

nearest known ligand 0.72

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ TRPA1 O75762 12/20 0.72
▸ EGFR P00533 1/20 0.52
▸ ERBB2 P04626 1/20 0.52
▸ KMT2A Q03164 4/20 0.49
▸ ALDH1A1 P00352 1/20 0.46
▸ MEN1 O00255 1/20 0.45

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
SCHEMBL28017899 0.85 TRPA1 (0.53) TRPA1EGFRERBB2KMT2AALDH1A1
SCHEMBL16894198 0.84 TRPA1 (1.00) TRPA1ALDH1A1
SCHEMBL16894096 0.82 TRPA1 (1.00) TRPA1ALDH1A1
SCHEMBL16894107 0.81 TRPA1 (0.69) TRPA1KMT2AALDH1A1MEN1
SCHEMBL16894237 0.81 TRPA1 (0.68) TRPA1
SCHEMBL16894173 0.79 TRPA1 (0.61) TRPA1
SCHEMBL16906693 0.78 TRPA1 (0.60) TRPA1KMT2AALDH1A1MEN1
SCHEMBL16894125 0.78 TRPA1 (0.63) TRPA1
SCHEMBL16894097 0.77 TRPA1 (0.59) TRPA1KMT2AALDH1A1MEN1
SCHEMBL16894136 0.77 TRPA1 (0.60) TRPA1

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
EP-2900642-B1 SUBSTITUTED SULFONAMIDE COMPOUNDS HOFFMANN LA ROCHE (CH) 2018-02-28 — — EP disclosed
EP-2900642-B1 SUBSTITUTED SULFONAMIDE COMPOUNDS HOFFMANN LA ROCHE (CH) 2018-02-28 — — EP disclosed
US-9580411-B2 Substituted sulfonamide compounds HOFFMANN-LA ROCHE INC. (US) 2017-02-28 — — US disclosed
US-9580411-B2 Substituted sulfonamide compounds HOFFMANN-LA ROCHE INC. (US) 2017-02-28 — — US disclosed
EP-2900642-A1 SUBSTITUTED SULFONAMIDE COMPOUNDS F. Hoffmann-La Roche AG (CH) 2015-08-05 — — EP disclosed
US-20150197509-A1 SUBSTITUTED SULFONAMIDE SOLUTIONS GENENTECH, INC. (US) 2015-07-16 — — US disclosed
US-20150197509-A1 SUBSTITUTED SULFONAMIDE SOLUTIONS GENENTECH, INC. (US) 2015-07-16 — — 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 (1 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-20150197509-A1 SUBSTITUTED SULFONAMIDE SOLUTIONS TRPA1, TRPV1, TRPV5 TRPA1 1/4885EGFR 1639/4885ERBB2 2603/4885

“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.

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