SCHEMBL22150338

SCHEMBL22150338

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

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.46
TRPM8 Q7Z2W7 2/20 0.46
HSP90AA1 P07900 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
SCHEMBL28185150 0.81 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL28409985 0.81 TRPA1 (0.35) TRPA1TRPM8
SCHEMBL27950890 0.76 TRPM8 (0.54) TRPA1TRPM8HSP90AA1
SCHEMBL1617617 0.74 TRPA1 (0.40) TRPA1TRPM8
SCHEMBL18105685 0.72 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL18105686 0.72 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL19920155 0.72 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL11677340 0.72 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL340924 0.72 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL5500416 0.72 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2950823-B1 LIQUID MENTHOL COMPOSITIONS DDROPS COMPANY (CA) 2020-07-01 EP disclosed