SCHEMBL6140972

SCHEMBL6140972

COc1cc(CN(C)c2ccc(Oc3ccccc3)cc2)ccc1C(N)=O

nearest known ligand 0.49

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.46
PARP15 Q460N3 3/20 0.45
PARP10 Q53GL7 2/20 0.45
CTNNB1 P35222 1/20 0.44
MCHR1 Q99705 3/20 0.43
NR3C1 P04150 1/20 0.42
LMNA P02545 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
RNF4 P78317 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
LPAR1 Q92633 2/20 0.41
LPAR5 Q9H1C0 2/20 0.41
MEN1 O00255 1/20 0.41
KMT2A Q03164 1/20 0.41

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
SCHEMBL6141007 0.93 PARP1 (0.48) PARP1PARP15PARP10CTNNB1MCHR1
SCHEMBL6141139 0.91 L3MBTL1 (0.46) PARP1PARP15PARP10LMNAHTT
SCHEMBL6140723 0.83 GAA (0.50) PARP1PARP15PARP10HTTL3MBTL1
SCHEMBL6140461 0.81 PARP15 (0.62) PARP15PARP10CTNNB1LMNAHTT
SCHEMBL6108706 0.80 MCHR1 (0.70) MCHR1
SCHEMBL6141239 0.79 PARP15 (0.65) PARP1PARP15PARP10CTNNB1LMNA
SCHEMBL6141248 0.78 FFAR1 (0.56)
SCHEMBL6141253 0.78 PARP15 (0.46) PARP15PARP10CTNNB1LMNAHTT
SCHEMBL6141272 0.76 HIF1A (0.56) PARP15PARP10MCHR1
SCHEMBL6108768 0.74 MCHR1 (0.73) 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