SCHEMBL6899358

SCHEMBL6899358

COc1ccc(NC(=O)c2ccc(Cc3ccccc3O)cc2)cc1OCCN(C(C)C)C(C)C

nearest known ligand 0.75

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 19/20 0.75
HTR2C P28335 1/20 0.67
HDAC1 Q13547 1/20 0.48
HDAC2 Q92769 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
SCHEMBL6899093 0.90 MCHR1 (0.93) MCHR1HTR2C
SCHEMBL6925443 0.86 MCHR1 (0.81) MCHR1HTR2C
SCHEMBL6896984 0.84 MCHR1 (0.78) MCHR1HTR2C
SCHEMBL6926340 0.84 MCHR1 (0.92) MCHR1HTR2C
SCHEMBL6898082 0.84 MCHR1 (0.78) MCHR1HTR2C
SCHEMBL6569830 0.83 MCHR1 (0.76) MCHR1HTR2C
SCHEMBL6926161 0.83 MCHR1 (0.76) MCHR1HTR2C
SCHEMBL6924942 0.82 MCHR1 (0.75) MCHR1HTR2C
SCHEMBL6895261 0.82 MCHR1 (0.93) MCHR1HTR2C
SCHEMBL6920748 0.82 MCHR1 (0.71) MCHR1HTR2C

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2000006146-A9 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORP (US) 2000-08-03 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