SCHEMBL6141007

SCHEMBL6141007

COc1cc(N(C)Cc2ccc(Oc3ccccc3)cc2)ccc1C(N)=O

nearest known ligand 0.48

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 1/20 0.48
RNF4 P78317 1/20 0.46
MCHR1 Q99705 2/20 0.46
PARP15 Q460N3 3/20 0.45
PARP10 Q53GL7 2/20 0.45
NR3C1 P04150 2/20 0.44
PGR P06401 2/20 0.44
TSHR P16473 2/20 0.44
CTNNB1 P35222 1/20 0.44
LPAR1 Q92633 3/20 0.43
LPAR5 Q9H1C0 2/20 0.43
PLA2G10 O15496 1/20 0.43
ACHE P22303 1/20 0.43

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
SCHEMBL6140972 0.93 PARP1 (0.46) PARP1RNF4MCHR1PARP15PARP10
SCHEMBL6140723 0.91 GAA (0.50) PARP1PARP15PARP10TSHRACHE
SCHEMBL6141139 0.83 L3MBTL1 (0.46) PARP1PARP15PARP10ACHE
SCHEMBL6108768 0.80 MCHR1 (0.73) MCHR1
SCHEMBL6140461 0.79 PARP15 (0.62) PARP15PARP10CTNNB1
SCHEMBL6141239 0.79 PARP15 (0.65) PARP1PARP15PARP10CTNNB1
SCHEMBL6141253 0.76 PARP15 (0.46) PARP15PARP10CTNNB1PLA2G10
SCHEMBL6141248 0.76 FFAR1 (0.56)
SCHEMBL6141272 0.76 HIF1A (0.56) MCHR1PARP15PARP10
SCHEMBL6108706 0.74 MCHR1 (0.70) 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