SCHEMBL8147103

SCHEMBL8147103

CC1CCC(C(C)C)C(C(N)(CO)P(=O)(O)O)C1

nearest known ligand 0.42

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.42
TRPM8 Q7Z2W7 5/20 0.40
TRPA1 O75762 2/20 0.40
KCNA5 P22460 1/20 0.39
ALDH1A1 P00352 4/20 0.39
LMNA P02545 1/20 0.39
TRPV1 Q8NER1 4/20 0.38
CYP19A1 P11511 2/20 0.36
HPGD P15428 2/20 0.34
KDM4E B2RXH2 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
MAPK1 P28482 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
SCHEMBL5680415 0.79 TRPM8 (0.47) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL8639019 0.75 EPHX1 (0.40) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL4958932 0.75 TRPM8 (0.50) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL29261176 0.74 EPHX1 (0.51) EPHX1TRPM8TRPA1ALDH1A1TRPV1
SCHEMBL30904661 0.73 TRPM8 (0.48) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL5981087 0.73 TRPM8 (0.48) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL8148497 0.73 TRPM8 (0.39) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL8145478 0.72 ALDH1A1 (0.42) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL8141077 0.72 EPHX1 (0.38) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL30846576 0.71 TRPM8 (0.46) EPHX1TRPM8TRPA1ALDH1A1TRPV1

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
WO-2000013690-A1 EXOCYCLIC-PHOSPHOETHANOLAMINES CLARION PHARMACEUTICALS, INC. (US) 2000-03-16 WO disclosed
US-5804569-A ANTIINFLAMMATORY, ANTIARRHYMIC AND LOCAL ANESTHETIC AGENT CLARION PHARMACEUTICALS INC. (US) 1998-09-08 US disclosed