SCHEMBL8837510

SCHEMBL8837510

C=CCC=CCC1CC(C)CCC1C(C)C

nearest known ligand 0.40

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 4/20 0.40
TRPA1 O75762 2/20 0.40
EPHX1 P07099 3/20 0.35
ALDH1A1 P00352 2/20 0.34
KDM4E B2RXH2 1/20 0.33
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
KCNA5 P22460 1/20 0.33
OPRM1 P35372 1/20 0.31
CYP19A1 P11511 2/20 0.30
CA1 P00915 1/20 0.30
CA2 P00918 1/20 0.30
TRPV1 Q8NER1 1/20 0.30
LMNA P02545 1/20 0.30

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
SCHEMBL4772063 0.85 TRPM8 (0.46) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL9641174 0.83 TRPM8 (0.41) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL5358187 0.78 TRPM8 (0.43) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL1380265 0.73 TRPM8 (0.41) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL2761888 0.72 TRPM8 (0.50) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL13733054 0.72 TRPM8 (0.50) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL1983430 0.70 TRPM8 (0.52) TRPM8TRPA1EPHX1ALDH1A1KCNA5
SCHEMBL4305614 0.69 TRPM8 (0.47) TRPM8TRPA1EPHX1ALDH1A1KDM4E
SCHEMBL24540327 0.69 TRPM8 (0.50) TRPM8TRPA1EPHX1ALDH1A1KCNA5
SCHEMBL19189292 0.69 TRPM8 (0.50) TRPM8TRPA1EPHX1ALDH1A1KCNA5

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
US-5688733-A TRANSITION METAL-IMIDOARYL AMINE COMPLEX DSM N.V. (NL) 1997-11-18 US disclosed