SCHEMBL6892149

SCHEMBL6892149

COc1ccc(NC(=O)c2ccc(S(=O)(=O)c3ccc(Cl)cc3)cc2)cc1OCCN(C(C)C)C(C)C

nearest known ligand 0.65

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 16/20 0.65
HTR2C P28335 1/20 0.65
ALDH1A1 P00352 1/20 0.48
HPGD P15428 1/20 0.48
HTT P42858 1/20 0.48
SMN1; SMN2 Q16637 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
SCHEMBL6898474 0.91 MCHR1 (0.74) MCHR1HTR2C
SCHEMBL6892155 0.88 MCHR1 (0.55) MCHR1HTR2CALDH1A1HPGDHTT
SCHEMBL6920748 0.86 MCHR1 (0.71) MCHR1HTR2CALDH1A1SMN1; SMN2
SCHEMBL7067789 0.86 MCHR1 (0.66) MCHR1HTR2C
SCHEMBL6569338 0.86 MCHR1 (0.74) MCHR1HTR2C
SCHEMBL6926161 0.85 MCHR1 (0.76) MCHR1HTR2CALDH1A1SMN1; SMN2
SCHEMBL6570697 0.84 MCHR1 (0.67) MCHR1HTR2CALDH1A1HPGD
SCHEMBL6926499 0.84 MCHR1 (0.66) MCHR1HTR2C
SCHEMBL6926745 0.84 MCHR1 (0.71) MCHR1HTR2CALDH1A1SMN1; SMN2
SCHEMBL6572097 0.84 MCHR1 (0.71) MCHR1HTR2CALDH1A1SMN1; SMN2

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 9 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 claimed
JP-2002521436-A 2002-07-16 JP claimed
EP-1100485-A1 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2001-05-23 EP claimed
WO-2000006146-A9 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2000-08-03 WO claimed
WO-2000006146-A1 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-10 WO claimed
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