SCHEMBL12413525

SCHEMBL12413525

CC1CCC(O)C(CC(C)(C)C)C1

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.36
TRPM8 Q7Z2W7 2/20 0.36

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
SCHEMBL21534009 0.83 TRPA1 (0.30) TRPA1TRPM8
SCHEMBL7634046 0.78 TRPA1 (0.39) TRPA1TRPM8
SCHEMBL805178 0.78 TRPA1 (0.41) TRPA1TRPM8
SCHEMBL12166555 0.76 TRPA1 (0.40) TRPA1TRPM8
SCHEMBL3479924 0.76 TRPA1 (0.40) TRPA1TRPM8
SCHEMBL13916212 0.76 TRPA1 (0.40) TRPA1TRPM8
SCHEMBL12166561 0.72 CA1 (0.54) TRPA1TRPM8
SCHEMBL12435688 0.71 CA1 (0.52)
SCHEMBL12435657 0.71 CA1 (0.52)
SCHEMBL11993679 0.71 CA1 (0.52)

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-20110165120-A1 INHIBITORS OF SERINE PROTEASES VERTEX PHARMACEUTICALS INCORPORATED (US) 2011-07-07 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-20110165120-A1 INHIBITORS OF SERINE PROTEASES PRSS1, PRSS3, PRSS2 TRPA1 3256/4885TRPM8 2135/4885

“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.