SCHEMBL7571291

SCHEMBL7571291

CC1CCC(CN)C(O)C1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.43
TRPM8 Q7Z2W7 2/20 0.43
EPHX2 P34913 1/20 0.34
GABRR1 P24046 4/20 0.32
GABRR2 P28476 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
CA4 P22748 1/20 0.32

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
SCHEMBL7634046 0.82 TRPA1 (0.39) TRPA1TRPM8EPHX2GABRR1GABRR2
SCHEMBL20124552 0.80 CA1 (0.36) GABRR1GABRR2CA1CA2CA4
SCHEMBL18644147 0.79 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL3249131 0.79 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL27732658 0.79 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL31516173 0.79 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL3479883 0.79 TRPA1 (0.45) TRPA1TRPM8EPHX2CA1CA2
SCHEMBL12159671 0.79 TRPA1 (0.45) TRPA1TRPM8CA1CA2CA4
SCHEMBL12077578 0.78 TRPA1 (0.33) TRPA1TRPM8EPHX2GABRR1GABRR2
SCHEMBL3537569 0.78 EPHX2 (0.33) EPHX2GABRR1GABRR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090325932-A1 4-PIPERIDYLBENZAMIDES AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS HIGH POINT PHARMACEUTICALS, LLC 2009-12-31 US disclosed
EP-0866055-B1 Pocess for the preparation of 1-amino-1-methyl-3(4)-aminomethylcyclohexane BAYER AG (DE) 2002-07-03 EP disclosed
US-5905170-A SIMULTANEOUSLY REACTING 4(5)-AMINOEMTHYL-1-METHYLCYCLOHEXANE, HYDROCYANIC ACID AND AQUEOUS SULFURIC ACID TO FORM 1-FORMAMIDO-1-METHYL-3(4)-AMINOMETHYLCYCLOHEXANE, HYDROLYZING THE FORMAMIDE AND HYDROCYANIC ACID, ADDING A BASE BAYER AKTIENGESELLSCHAFT (DE) 1999-05-18 US disclosed
EP-0866055-A2 Pocess for the preparation of 1-amino-1-mentyl-3(4)-aminomethylcyclohexane BAYER AG (DE) 1998-09-23 EP 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-20090325932-A1 4-PIPERIDYLBENZAMIDES AS 11-BETA-HYDROXYSTEROID DEHYDROGENASE TYPE 1 INHIBITORS HSD11B1, HSD3B1, HSD17B1 TRPA1 4362/4885TRPM8 4674/4885EPHX2 1520/4885

“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.