SCHEMBL4661801

SCHEMBL4661801

CC(C)C1CCCCC1C(C)OC(C)C1CCCCC1C(C)C

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TRPA1 O75762 2/20 0.33
TRPM8 Q7Z2W7 2/20 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
SCHEMBL18720931 0.76 TRPA1 (0.42) TRPA1TRPM8
SCHEMBL16191447 0.75 TRPA1 (0.37) TRPA1TRPM8
SCHEMBL4389938 0.72 TRPM8 (0.52) TRPA1TRPM8
SCHEMBL3311552 0.71 SHBG (0.39)
SCHEMBL1270214 0.69 TRPA1 (0.46) TRPA1TRPM8
SCHEMBL3313525 0.69 SHBG (0.43)
SCHEMBL10437743 0.69 SHBG (0.43)
SCHEMBL9398301 0.68 TRPA1 (0.33) TRPA1TRPM8
SCHEMBL19818246 0.67 TRPA1 (0.52) TRPA1TRPM8
SCHEMBL680648 0.67 TRPA1 (0.52) TRPA1TRPM8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1341512-B1 RHINOLOGICAL AGENTS SYMRISE GMBH & CO KG (DE) 2008-12-31 EP claimed
EP-1341512-A1 RHINOLOGICAL AGENTS HAARMANN & REIMER GMBH (DE) 2003-09-10 EP claimed
WO-2002041861-A1 RHINOLOGICAL AGENTS HAARMANN & REIMER GMBH (DE) 2002-05-30 WO claimed
EP-1341512-B1 RHINOLOGICAL AGENTS SYMRISE GMBH & CO KG (DE) 2008-12-31 EP disclosed
EP-1341512-A1 RHINOLOGICAL AGENTS HAARMANN & REIMER GMBH (DE) 2003-09-10 EP disclosed
WO-2002041861-A1 RHINOLOGICAL AGENTS HAARMANN & REIMER GMBH (DE) 2002-05-30 WO disclosed