SCHEMBL27708449

SCHEMBL27708449

CC1CCC(C(C)C)C(C(Cl)C(C)O)C1

nearest known ligand 0.52

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.52
TRPA1 O75762 2/20 0.52
EPHX1 P07099 3/20 0.44
TRPV1 Q8NER1 5/20 0.37
ALDH1A1 P00352 2/20 0.36
LMNA P02545 1/20 0.35
KCNA5 P22460 1/20 0.34
KDM4E B2RXH2 1/20 0.34
APOBEC3A P31941 1/20 0.34
APOBEC3G Q9HC16 1/20 0.34
GAA P10253 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 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
SCHEMBL28328623 0.80 TRPM8 (0.55) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL4389935 0.79 TRPM8 (0.65) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL13465301 0.79 TRPM8 (0.65) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL30604482 0.79 TRPM8 (0.62) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL10859205 0.76 EPHX1 (0.51) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL31443265 0.74 TRPM8 (0.58) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL38660082 0.74 EPHX1 (0.50) TRPM8TRPA1EPHX1TRPV1ALDH1A1
Bicarbonate SCHEMBL1660899 0.74 EPHX1 (0.50) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL8743483 0.74 EPHX1 (0.50) TRPM8TRPA1EPHX1TRPV1ALDH1A1
SCHEMBL18420148 0.74 TRPM8 (0.52) TRPM8TRPA1EPHX1TRPV1ALDH1A1

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-101200415-A Method for synthesizing cooling agent L-menthoxypropane SRIFFI (CN) 2008-06-18 CN disclosed