SCHEMBL6140571

SCHEMBL6140571

COc1cc(C(N)=O)ccc1C(=O)NCCCN(C)C

nearest known ligand 0.62

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MCHR1 Q99705 5/20 0.62
ALDH1A1 P00352 2/20 0.48
KDM4E B2RXH2 1/20 0.48
HPGD P15428 2/20 0.48
TLR9 Q9NR96 1/20 0.48
TLR8 Q9NR97 1/20 0.48
TLR7 Q9NYK1 1/20 0.48
POLB P06746 2/20 0.47
APP P05067 1/20 0.47
HTT P42858 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
CHEK1 O14757 1/20 0.46
DAPK3 O43293 1/20 0.46
PRKD3 O94806 1/20 0.46
MAP4K4 O95819 1/20 0.46
PAK4 O96013 1/20 0.46
ABL1 P00519 1/20 0.46
LCK P06239 1/20 0.46
RET P07949 1/20 0.46
MET P08581 1/20 0.46

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
SCHEMBL6109554 0.85 MCHR1 (0.60) MCHR1ALDH1A1KDM4EHPGDPOLB
SCHEMBL3414717 0.83 MCHR1 (0.65) MCHR1ALDH1A1TMEM97SIGMAR1
SCHEMBL3762391 0.82 MCHR1 (0.53) MCHR1ALDH1A1HPGDPOLBTMEM97
SCHEMBL3760668 0.82 MCHR1 (0.47) MCHR1ALDH1A1HPGDPOLBMAPK1
SCHEMBL1559086 0.80 HPGD (0.53) MCHR1ALDH1A1KDM4EHPGDTLR9
SCHEMBL3004623 0.79 HPGD (0.68) ALDH1A1KDM4EHPGDPOLBHTT
SCHEMBL12505361 0.79 POLB (0.56) POLBHTTSMN1; SMN2
SCHEMBL13886657 0.78 MCHR1 (0.78) MCHR1ALDH1A1KDM4EHPGDAPP
SCHEMBL14094304 0.78 TLR9 (0.54) MCHR1ALDH1A1KDM4EHPGDTLR9
SCHEMBL6110566 0.77 MCHR1 (1.00) MCHR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1497260-A1 NOVEL METHOXYBENZAMIDE COMPOUNDS FOR USE IN MCH RECEPTOR RELATED DISORDERS 7TM Pharma A/S (DK) 2005-01-19 EP disclosed
WO-2003087045-A1 NOVEL METHOXYBENZAMIDE COMPOUNDS FOR USE IN MCH RECEPTOR RELATED DISORDERS 7TM PHARMA A/S (DK) 2003-10-23 WO disclosed