SCHEMBL3422050

SCHEMBL3422050

CC1C[CH][C@H](C(C)C)CC1

nearest known ligand 0.32

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.32
TRPM8 Q7Z2W7 2/20 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
SCHEMBL20358052 1.00 TRPA1 (0.32) TRPA1TRPM8
SCHEMBL522463 1.00 TRPA1 (0.32) TRPA1TRPM8
SCHEMBL4622479 1.00 TRPA1 (0.32) TRPA1TRPM8
SCHEMBL3422054 1.00 TRPA1 (0.32) TRPA1TRPM8
SCHEMBL43485 1.00 TRPA1 (0.32) TRPA1TRPM8
SCHEMBL521672 1.00 TRPA1 (0.32) TRPA1TRPM8
Dimethyl Sulfoxide SCHEMBL7538397 0.89
SCHEMBL283746 0.74
SCHEMBL14109264 0.69
SCHEMBL8479861 0.68 SIGMAR1 (0.41) 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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2225232-B1 PROCESS FOR THE PREPARATION OF SUBSTITUTED 1,3-OXATHIOLANES RANBAXY LAB LTD (IN) 2012-09-26 EP disclosed
EP-2394703-A1 Cooling mixture with reinforced cooling effect of 5-methyl-2-(propan-2-yl)cyclohexyl-N-ethyloxamate Symrise AG (DE) 2011-12-14 EP disclosed
EP-2181980-A1 A process for the preparation of (R)-1-aminoindanes Chemo Ibérica, S.A. (ES) 2010-05-05 EP disclosed