SCHEMBL8639028

SCHEMBL8639028

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

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 3/20 0.43
TRPM8 Q7Z2W7 4/20 0.41
TRPA1 O75762 2/20 0.41
KCNA5 P22460 1/20 0.37
ALDH1A1 P00352 4/20 0.36
LMNA P02545 2/20 0.36
TRPV1 Q8NER1 4/20 0.34
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HPGD P15428 1/20 0.32

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
SCHEMBL8141080 0.90 EPHX1 (0.44) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL5680423 0.74 TRPM8 (0.52) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL8148565 0.73
SCHEMBL8642189 0.72
SCHEMBL8639023 0.70 EPHX1 (0.40) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL4389935 0.69 TRPM8 (0.65) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL13465301 0.69 TRPM8 (0.65) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL8991389 0.69 EPHX1 (0.47) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL28280924 0.69 TRPM8 (0.46) EPHX1TRPM8TRPA1KCNA5ALDH1A1
SCHEMBL30604482 0.69 TRPM8 (0.62) EPHX1TRPM8TRPA1KCNA5ALDH1A1

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-5804569-A ANTIINFLAMMATORY, ANTIARRHYMIC AND LOCAL ANESTHETIC AGENT CLARION PHARMACEUTICALS INC. (US) 1998-09-08 US disclosed