SCHEMBL6892162

SCHEMBL6892162

CCCN(CCC)CCOc1cc(NC(=O)c2cccc(Oc3ccccc3)c2)ccc1OC

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 14/20 0.71
MEN1 O00255 2/20 0.56
KMT2A Q03164 2/20 0.56
CASP3 P42574 1/20 0.56
SENP8 Q96LD8 1/20 0.56
SENP7 Q9BQF6 1/20 0.56
SENP6 Q9GZR1 1/20 0.56
PGR P06401 1/20 0.51
HTR2C P28335 1/20 0.50
FABP1 P07148 1/20 0.49
MAPT P10636 1/20 0.49
TSHR P16473 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
NR1H4 Q96RI1 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
SCHEMBL6893838 0.93 MCHR1 (0.72) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL6895401 0.92 MCHR1 (0.70) MCHR1MEN1KMT2APGRHTR2C
SCHEMBL10039646 0.89 MCHR1 (0.68) MCHR1MEN1KMT2AHTR2CSMN1; SMN2
SCHEMBL6901278 0.89 MCHR1 (0.60) MCHR1MEN1KMT2AHTR2C
SCHEMBL6899347 0.88 MCHR1 (0.60) MCHR1HTR2CSMN1; SMN2
SCHEMBL14964397 0.87 MCHR1 (0.64) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL6892159 0.87 MCHR1 (0.93) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL6898088 0.86 MCHR1 (0.67) MCHR1HTR2CSMN1; SMN2
SCHEMBL6898946 0.86 MEN1 (0.61) MCHR1MEN1KMT2ACASP3SENP8
SCHEMBL6897973 0.85 MCHR1 (0.75) MCHR1MEN1KMT2AHTR2CSMN1; 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 8 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-A1 SUBSTITUTED ANILIDE COMPOUNDS AND METHODS SMITHKLINE BEECHAM CORPORATION (US) 2000-02-10 WO disclosed