SCHEMBL13976366

SCHEMBL13976366

CCc1sc2c(c1CC(=O)Nc1nc(-c3cc(F)c(O)c(F)c3)cs1)c(=O)n(C)c(=O)n2C

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 20/20 0.80
TRPV4 Q9HBA0 6/20 0.78

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
SCHEMBL14317999 0.91 TRPA1 (0.84) TRPA1TRPV4
SCHEMBL13174922 0.89 TRPA1 (1.00) TRPA1TRPV4
SCHEMBL13834516 0.88 TRPA1 (1.00) TRPA1TRPV4
SCHEMBL474749 0.87 TRPA1 (1.00) TRPA1TRPV4
SCHEMBL13174925 0.83 TRPA1 (0.89) TRPA1TRPV4
SCHEMBL13174948 0.83 TRPA1 (0.69) TRPA1TRPV4
SCHEMBL474672 0.81 TRPA1 (0.89) TRPA1TRPV4
SCHEMBL13966937 0.81 TRPA1 (0.74) TRPA1TRPV4
SCHEMBL15158286 0.81 TRPA1 (0.79) TRPA1TRPV4
SCHEMBL474685 0.78 TRPA1 (0.83) TRPA1TRPV4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120295924-A1 THIENOPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS GLENMARK PHARMACEUTICALS S.A. (CH) 2012-11-22 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 (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-20120295924-A1 THIENOPYRIMIDINEDIONE DERIVATIVES AS TRPA1 MODULATORS TRPA1, TRPV1, TRPV6 TRPA1 1/4885TRPV4 6/4885

“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.