SCHEMBL5500416

SCHEMBL5500416

CC(C)[C@@H]1CC[C@](C)([C@]2(C)CC[C@@H](C(C)C)[C@H](O)C2)C[C@H]1O

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.42
TRPM8 Q7Z2W7 2/20 0.42

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
SCHEMBL340924 1.00 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL1617146 1.00 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL9420479 0.85 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL19920155 0.83 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL18105686 0.83 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL9559604 0.83 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL18105685 0.83 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL11677340 0.83 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL18105741 0.83 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL19920235 0.83 TRPA1 (0.42) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1222932-B1 COMPOSITIONS FOR ELECTROPORATION POLA CHEM IND INC (JP) 2007-02-21 EP claimed
EP-0134303-B1 MENTHYL 2,2-DIMETHYLCYCLOPROPANECARBOXYLATE AND RESOLUTION OF THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-01-27 EP claimed
CN-100408021-C Skin external preparation SHISEIDO CO LTD (JP) 2008-08-06 CN disclosed
CN-1408339-A Skin external preparation SHISEIDO CO LTD (JP) 2003-04-09 CN disclosed