SCHEMBL8330604

SCHEMBL8330604

CC(C)CP(=O)(C#N)CC(C)C

nearest known ligand 0.34

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TRPM8 Q7Z2W7 1/20 0.34

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
SCHEMBL2010 0.67
SCHEMBL576093 0.65 TRPM8 (0.55) TRPM8
SCHEMBL12358594 0.63 TRPM8 (0.40) TRPM8
SCHEMBL575881 0.63
Cyanide SCHEMBL28246787 0.63 ACHE (0.34)
SCHEMBL8331055 0.63 ACHE (0.34)
SCHEMBL20841435 0.63 ANPEP (0.39) TRPM8
SCHEMBL22772598 0.62
SCHEMBL16333883 0.61 ANPEP (0.37) TRPM8
SCHEMBL11768178 0.61

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0948506-A1 CYANOPHOSPHONATE DERIVATIVES MONSANTO COMPANY (US) 1999-10-13 EP disclosed
US-5935542-A Cyanphosphonate derivatives and method for their preparation MONSANTO COMPANY (US) 1999-08-10 US disclosed
WO-1998029422-A1 CYANOPHOSPHONATE DERIVATIVES MONSANTO COMPANY (US) 1998-07-09 WO disclosed