SCHEMBL28635808

SCHEMBL28635808

CC1CCC(C(C)C)C(c2ccccc2-c2ccccc2)C1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 3/20 0.46
KCNA5 P22460 1/20 0.46
ALDH1A1 P00352 2/20 0.45
LMNA P02545 2/20 0.45
TRPV1 Q8NER1 1/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
TRPA1 O75762 2/20 0.38
OPRM1 P35372 1/20 0.37
HPGD P15428 1/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
NPSR1 Q6W5P4 2/20 0.36
NTSR1 P30989 1/20 0.36
NPC1 O15118 1/20 0.35
MITF O75030 1/20 0.35
TP53 P04637 1/20 0.35
MAPK1 P28482 1/20 0.35
HTT P42858 1/20 0.35
RAB9A P51151 1/20 0.35

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
SCHEMBL10700915 0.86 KCNA5 (0.50) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL8498802 0.80 KCNA5 (0.46) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL7752054 0.80 TRPM8 (0.42) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL8336802 0.79 KCNA5 (0.44) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL5824341 0.79 OPRM1 (0.47) TRPM8KCNA5ALDH1A1LMNATRPA1
SCHEMBL3639819 0.78 KCNA5 (0.53) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL1872252 0.77 ALDH1A1 (0.49) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL2392586 0.77 OPRM1 (0.45) TRPM8KCNA5ALDH1A1LMNATRPV1
SCHEMBL7540738 0.77 KDM1A (0.49) TRPM8KCNA5ALDH1A1LMNATRPA1
SCHEMBL17847282 0.77 HTR2C (0.46) TRPM8KCNA5ALDH1A1LMNATRPV1

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-113270641-B Preparation method of single-ion conductor gel electrolyte based on in-situ polymerization 北京化工大学 2022-03-29 CN disclosed
CN-113270641-A Preparation method of single-ion conductor gel electrolyte based on in-situ polymerization 北京化工大学 2021-08-17 CN disclosed