SCHEMBL4660498

SCHEMBL4660498

CCC(OC(CC)C(C)C1CCCC(C)(C)C1)C(C)C1CCCC(C)(C)C1

nearest known ligand 0.31

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 1/20 0.31
TDO2 P48775 1/20 0.31
SHBG P04278 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
SCHEMBL5708038 0.83 IDO1 (0.31) IDO1TDO2
SCHEMBL5708063 0.83 IDO1 (0.31) IDO1TDO2
SCHEMBL5708070 0.82 IDO1 (0.30) IDO1TDO2
SCHEMBL5708112 0.81 EPHX1 (0.30)
SCHEMBL5708048 0.80
SCHEMBL4660465 0.79 IDO1 (0.33) IDO1TDO2
SCHEMBL5708118 0.78
SCHEMBL30491994 0.77 SHBG (0.35) IDO1TDO2SHBG
SCHEMBL4660459 0.72
SCHEMBL21786322 0.72 IDO1 (0.34) IDO1TDO2

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 4 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