SCHEMBL16635478

SCHEMBL16635478

NCc1cn(-c2ccc(C(F)(F)F)cc2)nc1Cl

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 8/20 0.44
NOTUM Q6P988 2/20 0.42
SRC P12931 1/20 0.39
BRAF P15056 1/20 0.39
KDR P35968 1/20 0.39
AADAT Q8N5Z0 1/20 0.39
ADORA3 P0DMS8 1/20 0.38
PTGS2 P35354 1/20 0.36
KCNH2 Q12809 1/20 0.35
TAAR1 Q96RJ0 1/20 0.35
CA12 O43570 2/20 0.34
CA2 P00918 2/20 0.34
CA9 Q16790 2/20 0.34
RXRA P19793 1/20 0.34
GRIN1 Q05586 1/20 0.34
GRIN2B Q13224 1/20 0.34
CA1 P00915 1/20 0.34

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
SCHEMBL16635640 0.80 TRPA1 (0.48) TRPA1
SCHEMBL19807675 0.79 TRPA1 (0.46) TRPA1NOTUMSRCBRAFKDR
SCHEMBL16634867 0.78 TRPA1 (0.47) TRPA1NOTUMSRCBRAFKDR
SCHEMBL19807429 0.78 TRPA1 (0.48) TRPA1NOTUMSRCBRAFKDR
SCHEMBL31596301 0.73 NOTUM (0.45) TRPA1NOTUMSRCBRAFKDR
SCHEMBL5004852 0.73 CTSS (0.44) TRPA1NOTUMSRCBRAFKDR
SCHEMBL16635963 0.72 NPC1 (0.55) ADORA3
Hydrochloric Acid SCHEMBL16635660 0.72 NPC1 (0.54) ADORA3
SCHEMBL5001181 0.70 NOTUM (0.52) TRPA1NOTUMSRCBRAFKDR
SCHEMBL19807771 0.70 TRPA1 (0.63) 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 22 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11236046-B2 Substituted heterocyclic sulfonamide compounds useful as TRPA1 modulators GENENTECH, INC. (US) 2022-02-01 US disclosed
US-11236046-B2 Substituted heterocyclic sulfonamide compounds useful as TRPA1 modulators GENENTECH, INC. (US) 2022-02-01 US disclosed
US-10766878-B2 Sulfonylcycloalkyl carboxamide compounds GENENTECH, INC. (US) 2020-09-08 US disclosed
US-10766878-B2 Sulfonylcycloalkyl carboxamide compounds GENENTECH, INC. (US) 2020-09-08 US disclosed
US-20200048197-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2020-02-13 US disclosed
US-20200048197-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2020-02-13 US disclosed
EP-3487849-A1 SULFONYLCYCLOALKYL CARBOXAMIDE COMPOUNDS AS TRPA1 MODULATORS H. Hoffnabb-La Roche Ag (CH) 2019-05-29 EP disclosed
US-20190144430-A1 SULFONYLCYCLOALKYL CARBOXAMIDE COMPOUNDS GENENTECH, INC. (US) 2019-05-16 US disclosed
US-20190144430-A1 SULFONYLCYCLOALKYL CARBOXAMIDE COMPOUNDS GENENTECH, INC. (US) 2019-05-16 US disclosed
EP-3055302-B1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS HOFFMANN LA ROCHE (CH) 2018-12-26 EP disclosed
US-20180118680-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2018-05-03 US disclosed
US-20180118680-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2018-05-03 US disclosed
WO-2018015411-A1 SULFONYLCYCLOALKYL CARBOXAMIDE COMPOUNDS AS TRPA1 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2018-01-25 WO disclosed
WO-2018015411-A1 SULFONYLCYCLOALKYL CARBOXAMIDE COMPOUNDS AS TRPA1 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2018-01-25 WO disclosed
EP-3055302-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS F. Hoffmann-La Roche AG (CH) 2016-08-17 EP disclosed
US-20160221945-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2016-08-04 US disclosed
US-20160221945-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2016-08-04 US disclosed
US-20160221945-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS GENENTECH, INC. (US) 2016-08-04 US disclosed
WO-2015052264-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2015-04-16 WO disclosed
WO-2015052264-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS F. HOFFMANN-LA ROCHE AG (CH) 2015-04-16 WO 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 (6 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-20160221945-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS TRPA1, TRPV1, TRPV2 TRPA1 1/4885NOTUM 2522/4885SRC 2574/4885
US-20190144430-A1 SULFONYLCYCLOALKYL CARBOXAMIDE COMPOUNDS TRPA1, TRPV1, TRPV5 TRPA1 1/4885NOTUM 833/4885SRC 1839/4885
US-20180118680-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS TRPA1, TRPV1, TRPV2 TRPA1 1/4885NOTUM 2522/4885SRC 2574/4885
US-20200048197-A1 SUBSTITUTED HETEROCYCLIC SULFONAMIDE COMPOUNDS USEFUL AS TRPA1 MODULATORS TRPA1, TRPV1, TRPV2 TRPA1 1/4885NOTUM 2522/4885SRC 2574/4885
US-10766878-B2 Sulfonylcycloalkyl carboxamide compounds TRPA1, TRPV1, TRPV5 TRPA1 1/4885NOTUM 833/4885SRC 1839/4885
US-11236046-B2 Substituted heterocyclic sulfonamide compounds useful as TRPA1 modulators TRPA1, TRPV1, TRPV2 TRPA1 1/4885NOTUM 2522/4885SRC 2574/4885

“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.