SCHEMBL7206161

SCHEMBL7206161

CCCCCN(C)CCCCCCOC1CCC(N(C)C(=O)c2ccc(C(F)(F)F)cc2)CC1

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.47
LSS P48449 5/20 0.45
LIPC P11150 1/20 0.39
LIPG Q9Y5X9 1/20 0.39

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
SCHEMBL7209098 1.00 MCHR1 (0.47) MCHR1LSSLIPCLIPG
SCHEMBL7209094 1.00 MCHR1 (0.47) MCHR1LSSLIPCLIPG
SCHEMBL7204624 0.90 LSS (0.56) MCHR1LSS
SCHEMBL7204630 0.90 LSS (0.56) MCHR1LSS
SCHEMBL7204876 0.90 LSS (0.56) MCHR1LSS
SCHEMBL7204881 0.90 LSS (0.56) MCHR1LSS
SCHEMBL7206164 0.89 MCHR1 (0.46) MCHR1LSSLIPCLIPG
SCHEMBL7212791 0.89 LSS (0.45) MCHR1LSS
SCHEMBL7209249 0.89 LSS (0.45) MCHR1LSS
SCHEMBL7212794 0.89 LSS (0.45) MCHR1LSS

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
EP-1311475-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2003-05-21 EP disclosed
WO-2002014267-A1 NOVEL AMINOCYCLOHEXANE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2002-02-21 WO disclosed