SCHEMBL9753953

SCHEMBL9753953

CCCCCN(C1CC(C)CCC1C(C)C)C1CC(C)CCC1C(C)C

nearest known ligand 0.42

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
OPRM1 P35372 2/20 0.42
TRPM8 Q7Z2W7 3/20 0.41
TRPA1 O75762 2/20 0.41
EPHX1 P07099 1/20 0.36
ALDH1A1 P00352 1/20 0.35
ADH1C P00326 1/20 0.33
ADH1A P07327 1/20 0.33
ADH4 P08319 1/20 0.33
KCNA5 P22460 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
SCHEMBL31105805 0.86 TRPM8 (0.48) OPRM1TRPM8TRPA1EPHX1ALDH1A1
SCHEMBL9215244 0.86 OPRM1 (0.41) OPRM1TRPM8TRPA1EPHX1ALDH1A1
Hydrochloric Acid SCHEMBL14320260 0.85 OPRM1 (0.33) OPRM1TRPM8TRPA1ALDH1A1
SCHEMBL3383827 0.84 TRPM8 (0.41) OPRM1TRPM8TRPA1EPHX1ALDH1A1
SCHEMBL5307491 0.81 TRPM8 (0.47) OPRM1TRPM8TRPA1EPHX1ALDH1A1
SCHEMBL3053468 0.80 DNM1 (0.49) ALDH1A1
SCHEMBL5680417 0.80 TRPM8 (0.47) OPRM1TRPM8TRPA1EPHX1ALDH1A1
SCHEMBL8038624 0.79 OPRM1 (0.34) OPRM1TRPM8TRPA1EPHX1
SCHEMBL31148972 0.79 TDP1 (0.38) TRPM8TRPA1EPHX1ALDH1A1
Hydrochloric Acid SCHEMBL27721782 0.79 TRPM8 (0.42) 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
WO-1991009141-A1 MAGNETICALLY RESPONSIVE FLUORESCENT POLYMER PARTICLES AND APPLICATION THEREOF BAXTER DIAGNOSTICS INC. (US) 1991-06-27 WO disclosed