SCHEMBL31152467

SCHEMBL31152467

CC(C)[C@@H]1CC[C@@H](C)C[C@H]1C(O)CCO

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.48
TRPA1 O75762 2/20 0.48
EPHX1 P07099 3/20 0.42
ALDH1A1 P00352 2/20 0.37
LMNA P02545 1/20 0.37
MEN1 O00255 1/20 0.36
KMT2A Q03164 1/20 0.36
KDM4E B2RXH2 1/20 0.35
APOBEC3A P31941 1/20 0.35
APOBEC3G Q9HC16 1/20 0.35
GAA P10253 1/20 0.35
OPRM1 P35372 1/20 0.33
CYP19A1 P11511 2/20 0.33
TRPV1 Q8NER1 2/20 0.33
KCNA5 P22460 1/20 0.33

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
SCHEMBL1862576 0.86 TRPM8 (0.48) TRPM8TRPA1EPHX1ALDH1A1LMNA
SCHEMBL21380098 0.86 TRPM8 (0.48) TRPM8TRPA1EPHX1ALDH1A1LMNA
SCHEMBL31148535 0.85 TRPM8 (0.52) TRPM8TRPA1EPHX1ALDH1A1LMNA
Bicarbonate SCHEMBL1660906 0.79 EPHX1 (0.47) TRPM8TRPA1EPHX1ALDH1A1LMNA
SCHEMBL10713470 0.79 TRPM8 (0.46) TRPM8TRPA1EPHX1ALDH1A1LMNA
Water SCHEMBL30690409 0.79 TRPM8 (0.48) TRPM8TRPA1EPHX1ALDH1A1LMNA
SCHEMBL31152472 0.77 TRPM8 (0.32) TRPM8TRPA1EPHX1
SCHEMBL28738013 0.77 TRPM8 (0.47) TRPM8TRPA1EPHX1ALDH1A1LMNA
SCHEMBL18280698 0.77 EPHX1 (0.45) TRPM8TRPA1EPHX1ALDH1A1CYP19A1
SCHEMBL4389935 0.77 TRPM8 (0.65) TRPM8TRPA1EPHX1ALDH1A1LMNA

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-118742286-A Cooling compound and composition 玛奈·菲尔萨公司 2024-10-01 CN disclosed