SCHEMBL28534669

SCHEMBL28534669

CC1CCC(C(C)C)C(N(C=O)C2CC2)C1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.43
TRPA1 O75762 2/20 0.43
EPHX1 P07099 3/20 0.41
ADH1A P07327 5/20 0.39
ADH1C P00326 3/20 0.39
ADH4 P08319 1/20 0.39
KCNA5 P22460 1/20 0.35
ALDH1A1 P00352 2/20 0.33
TRPV1 Q8NER1 3/20 0.32
LMNA P02545 1/20 0.32
NFE2L2 Q16236 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
SCHEMBL1358316 0.91 TRPM8 (0.47) TRPM8TRPA1EPHX1ADH1AADH1C
SCHEMBL5412356 0.80 TRPM8 (0.47) TRPM8TRPA1EPHX1KCNA5ALDH1A1
SCHEMBL28012004 0.75 ADH1A (0.47) TRPM8TRPA1EPHX1ADH1AADH1C
SCHEMBL27484514 0.75 TRPM8 (0.42) TRPM8TRPA1EPHX1ADH1AADH1C
SCHEMBL15435867 0.74 TRPM8 (0.52) TRPM8TRPA1EPHX1KCNA5ALDH1A1
SCHEMBL26355350 0.74 TRPM8 (0.52) TRPM8TRPA1EPHX1KCNA5ALDH1A1
SCHEMBL2666136 0.73 ADH1A (0.48) TRPM8TRPA1EPHX1ADH1AADH1C
SCHEMBL15435866 0.72 TRPM8 (0.50) TRPM8TRPA1EPHX1KCNA5ALDH1A1
SCHEMBL10642094 0.71 TRPM8 (0.46) TRPM8TRPA1EPHX1KCNA5ALDH1A1
SCHEMBL584097 0.71 EPHX1 (0.44) TRPM8TRPA1EPHX1KCNA5ALDH1A1

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
CN-112384077-A Solubilization of poorly soluble cooling substances 西姆莱斯有限公司 2021-02-19 CN claimed
CN-112384077-A Solubilization of poorly soluble cooling substances 西姆莱斯有限公司 2021-02-19 CN disclosed