SCHEMBL29112341

SCHEMBL29112341

CC1CCC(C(C)C)[C@@](O)(C=O)C1

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.33
TRPM8 Q7Z2W7 2/20 0.33
EPHX1 P07099 1/20 0.33
TRPV1 Q8NER1 1/20 0.31

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
SCHEMBL29112340 1.00 TRPA1 (0.33) TRPA1TRPM8EPHX1TRPV1
SCHEMBL30626437 1.00 TRPA1 (0.33) TRPA1TRPM8EPHX1TRPV1
SCHEMBL24540324 0.81 GPBAR1 (0.30)
SCHEMBL25427457 0.77 TRPA1 (0.31) TRPA1TRPM8EPHX1
SCHEMBL31152474 0.77 TRPA1 (0.31) TRPA1TRPM8EPHX1
SCHEMBL25426053 0.77 TRPA1 (0.31) TRPA1TRPM8EPHX1
SCHEMBL14515122 0.74 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL1870837 0.74 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL30297195 0.73
SCHEMBL12671701 0.72 TRPA1 (0.33) TRPA1TRPM8

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
CN-116829532-A Substituted cyclohexane carboxamides, their preparation and their therapeutic use 赛诺菲 2023-09-29 CN disclosed