SCHEMBL6895247

SCHEMBL6895247

CCCN(CCC)CCCc1cc(NC(=O)c2cccc(Oc3ccccc3)c2)ccc1OC

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 4/20 0.57
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
PGR P06401 2/20 0.50
CASP3 P42574 1/20 0.50
SENP8 Q96LD8 1/20 0.50
SENP7 Q9BQF6 1/20 0.50
SENP6 Q9GZR1 1/20 0.50
KCNK3 O14649 1/20 0.47
KCNK9 Q9NPC2 1/20 0.47
HTR1D P28221 1/20 0.47
HTR1B P28222 1/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
MAPT P10636 3/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
AR P10275 2/20 0.47
PPARG P37231 1/20 0.47
PPARD Q03181 1/20 0.47
PPARA Q07869 1/20 0.47

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
SCHEMBL6901301 0.93 MCHR1 (0.58) MCHR1MEN1KMT2APGRHTR1D
SCHEMBL6895242 0.87 MCHR1 (0.73) MCHR1MEN1KMT2APGRCASP3
SCHEMBL6896357 0.87 ATM (0.52) MCHR1MEN1KMT2AHTR1DHTR1B
SCHEMBL6892162 0.84 MCHR1 (0.71) MCHR1MEN1KMT2APGRCASP3
SCHEMBL6898063 0.83 MCHR1 (0.56) MCHR1HTR1DHTR1B
SCHEMBL6901296 0.79 MCHR1 (0.72) MCHR1MEN1KMT2APGRHTR1D
SCHEMBL6901304 0.78 AQP1 (0.64) MCHR1MAPTALDH1A1LMNA
SCHEMBL6898946 0.77 MEN1 (0.61) MCHR1MEN1KMT2APGRCASP3
SCHEMBL6893838 0.77 MCHR1 (0.72) MCHR1MEN1KMT2APGRCASP3
SCHEMBL6895427 0.77 MAPT (0.52) MEN1KMT2ASMN1; SMN2MAPTNPC1

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-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