SCHEMBL6898482

SCHEMBL6898482

CC(C)N(CCOc1ccccc1NC(=O)c1ccc(Cc2ccccc2)cc1)C(C)C

nearest known ligand 0.68

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.68
LTA4H P09960 1/20 0.55
HTR2C P28335 1/20 0.54
GAA P10253 2/20 0.52
CACNA1H O95180 1/20 0.48
CACNA1B Q00975 1/20 0.48
ALDH1A1 P00352 1/20 0.48

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
SCHEMBL6926500 0.89 MCHR1 (0.69) MCHR1HTR2CGAACACNA1HCACNA1B
SCHEMBL6927041 0.87 MCHR1 (0.55) MCHR1HTR2CGAACACNA1HCACNA1B
SCHEMBL6927883 0.87 MCHR1 (0.58) MCHR1HTR2CGAAALDH1A1
SCHEMBL6900340 0.87 MCHR1 (0.68) MCHR1HTR2CGAACACNA1HCACNA1B
SCHEMBL6921912 0.86 MCHR1 (0.54) MCHR1HTR2CGAACACNA1HCACNA1B
SCHEMBL6927049 0.86 GAA (0.57) MCHR1HTR2CGAACACNA1HCACNA1B
SCHEMBL6926051 0.85 MCHR1 (0.53) MCHR1HTR2CGAACACNA1HCACNA1B
SCHEMBL6898504 0.85 GAA (0.56) MCHR1LTA4HGAACACNA1HCACNA1B
SCHEMBL6898486 0.84 GAA (0.58) MCHR1LTA4HGAACACNA1HCACNA1B
SCHEMBL6801515 0.82 MCHR1 (0.80) MCHR1LTA4HHTR2C

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-1100485-A4 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2004-06-09 EP disclosed
EP-1100485-A1 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2001-05-23 EP disclosed
WO-2000006146-A9 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2000-08-03 WO disclosed
WO-2000006146-A1 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-10 WO disclosed