SCHEMBL6892159

SCHEMBL6892159

COc1ccc(NC(=O)c2cccc(Oc3ccccc3)c2)cc1OCCN(C(C)C)C(C)C

nearest known ligand 0.93

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 18/20 0.93
HTR2C P28335 1/20 0.67
MEN1 O00255 1/20 0.56
CASP3 P42574 1/20 0.56
KMT2A Q03164 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
SLC2A1 P11166 1/20 0.52

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
SCHEMBL6895261 0.92 MCHR1 (0.93) MCHR1HTR2C
Iodomethane SCHEMBL6899429 0.91 MCHR1 (0.89) MCHR1HTR2C
SCHEMBL6925443 0.90 MCHR1 (0.81) MCHR1HTR2CSLC2A1
SCHEMBL6894756 0.89 MCHR1 (0.76) MCHR1HTR2CSLC2A1
SCHEMBL6927129 0.89 MCHR1 (0.93) MCHR1HTR2CSLC2A1
SCHEMBL6899341 0.88 MCHR1 (0.78) MCHR1HTR2C
SCHEMBL6893838 0.88 MCHR1 (0.72) MCHR1HTR2CMEN1CASP3KMT2A
SCHEMBL6892162 0.87 MCHR1 (0.71) MCHR1HTR2CMEN1CASP3KMT2A
SCHEMBL6898082 0.86 MCHR1 (0.78) MCHR1HTR2CSLC2A1
SCHEMBL6811436 0.86 MCHR1 (0.75) MCHR1HTR2CMEN1CASP3KMT2A

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