SCHEMBL6893838

SCHEMBL6893838

CCN(CC)CCOc1cc(NC(=O)c2cccc(Oc3ccccc3)c2)ccc1OC

nearest known ligand 0.72

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.72
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
CASP3 P42574 1/20 0.57
SENP8 Q96LD8 1/20 0.57
SENP7 Q9BQF6 1/20 0.57
SENP6 Q9GZR1 1/20 0.57
KDR P35968 3/20 0.55
PGR P06401 1/20 0.52
HTR2C P28335 1/20 0.51

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
SCHEMBL14964397 0.94 MCHR1 (0.64) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL6892162 0.93 MCHR1 (0.71) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL6897973 0.92 MCHR1 (0.75) MCHR1MEN1KMT2AHTR2C
SCHEMBL10039646 0.88 MCHR1 (0.68) MCHR1MEN1KMT2AHTR2C
SCHEMBL6892159 0.88 MCHR1 (0.93) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL10039400 0.87 MCHR1 (0.67) MCHR1MEN1KMT2AHTR2C
SCHEMBL12531387 0.87 MCHR1 (0.67) MCHR1MEN1KMT2AHTR2C
SCHEMBL12531391 0.87 MCHR1 (0.67) MCHR1MEN1KMT2AHTR2C
SCHEMBL6923947 0.86 MCHR1 (0.66) MCHR1KDRHTR2C
SCHEMBL6808533 0.86 MEN1 (0.71) MCHR1MEN1KMT2ACASP3SENP8

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