SCHEMBL28095105

SCHEMBL28095105

CC(=O)C1(C)CCC(C(C)C)C(O)C1

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.36
TRPM8 Q7Z2W7 2/20 0.36
CYP19A1 P11511 1/20 0.33
FFAR3 O14843 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
Lactic Acid SCHEMBL27735041 0.92 TP53 (0.33) TRPA1TRPM8CYP19A1FFAR3
SCHEMBL7978197 0.86 FFAR3 (0.45) TRPA1TRPM8FFAR3
SCHEMBL7978202 0.86 FFAR3 (0.45) TRPA1TRPM8FFAR3
SCHEMBL305654 0.84 TRPA1 (0.35) TRPA1TRPM8FFAR3
SCHEMBL28034706 0.84 TRPA1 (0.39) TRPA1TRPM8FFAR3
SCHEMBL305655 0.84 TRPA1 (0.35) TRPA1TRPM8FFAR3
Potassium Ion SCHEMBL29504220 0.83 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL30034418 0.83 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL30185795 0.83 TRPA1 (0.34) TRPA1TRPM8
SCHEMBL29990852 0.83 TRPA1 (0.34) 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-105832970-A Propolis and mint tincture and preparation method thereof 武汉思维特食品有限公司 2016-08-10 CN disclosed