SCHEMBL6900340

SCHEMBL6900340

CC(C)N(CCOc1ccccc1NC(=O)c1ccc(Oc2ccccc2)cc1)C(C)C

nearest known ligand 0.68

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 12/20 0.68
CACNA1H O95180 4/20 0.62
CACNA1B Q00975 2/20 0.62
HTR2C P28335 1/20 0.54
GAA P10253 2/20 0.52
MEN1 O00255 1/20 0.49
RAB9A P51151 1/20 0.49
KMT2A Q03164 1/20 0.49
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
SCHEMBL6897983 0.90 MCHR1 (0.71) MCHR1CACNA1HCACNA1BHTR2CMEN1
SCHEMBL6926500 0.89 MCHR1 (0.69) MCHR1CACNA1HCACNA1BHTR2CGAA
SCHEMBL6927041 0.87 MCHR1 (0.55) MCHR1CACNA1HCACNA1BHTR2CGAA
SCHEMBL6898482 0.87 MCHR1 (0.68) MCHR1CACNA1HCACNA1BHTR2CGAA
SCHEMBL6921912 0.86 MCHR1 (0.54) MCHR1CACNA1HCACNA1BHTR2CGAA
SCHEMBL6927049 0.86 GAA (0.57) MCHR1CACNA1HCACNA1BHTR2CGAA
SCHEMBL6926051 0.85 MCHR1 (0.53) MCHR1CACNA1HCACNA1BHTR2CGAA
SCHEMBL7056986 0.85 CACNA1H (0.63) MCHR1CACNA1HCACNA1BGAAMEN1
SCHEMBL6900342 0.84 CACNA1H (0.62) MCHR1CACNA1HCACNA1BGAAMEN1
SCHEMBL6807981 0.84 MCHR1 (0.83) MCHR1CACNA1HCACNA1BHTR2CMEN1

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