SCHEMBL805178

SCHEMBL805178

CC1CCC(O)C(CC2CC(C)CCC2O)C1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.41
TRPM8 Q7Z2W7 2/20 0.41
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
CA4 P22748 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.30

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
SCHEMBL12166555 0.83 TRPA1 (0.40) TRPA1TRPM8CA1CA2CA4
SCHEMBL3479924 0.83 TRPA1 (0.40) TRPA1TRPM8CA1CA2CA4
SCHEMBL13916212 0.83 TRPA1 (0.40) TRPA1TRPM8CA1CA2CA4
SCHEMBL7634046 0.81 TRPA1 (0.39) TRPA1TRPM8CA1CA2CA4
SCHEMBL12166561 0.79 CA1 (0.54) TRPA1TRPM8CA1CA2CA4
SCHEMBL14984117 0.78 TRPA1 (0.45) TRPA1TRPM8
SCHEMBL12413525 0.78 TRPA1 (0.36) TRPA1TRPM8
SCHEMBL19084224 0.76 CA1 (0.41) TRPA1TRPM8CA1CA2CA4
SCHEMBL12166560 0.76 CA1 (0.41) TRPA1TRPM8CA1CA2CA4
SCHEMBL6306091 0.74 L3MBTL1 (0.32) TRPA1TRPM8L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120070594-A1 HYDROGENATED BISPHENOL-A-BASED POLYMERS AS SUBSTITUTES FOR BISPHENOL-A-BASED POLYMERS EMPIRE TECHNOLOGY DEVELOPMENT LLC 2012-03-22 US disclosed
US-6531429-B2 Lubricant compositions comprising thiophosphoric acid esters and dithiophosphoric acid esters CIBA SPECIALTY CHEMICALS CORPORATION 2003-03-11 US disclosed