SCHEMBL6140763

SCHEMBL6140763

COc1cc(S(=O)(=O)Nc2ccccc2)ccc1C(N)=O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 1/20 0.72
CA9 Q16790 1/20 0.72
GPR27 Q9NS67 4/20 0.60
AVPR2 P30518 3/20 0.60
HTT P42858 3/20 0.58
ALDH1A1 P00352 4/20 0.58
SMN1; SMN2 Q16637 4/20 0.58
KDM4E B2RXH2 1/20 0.58
HSD17B10 Q99714 1/20 0.58
MEN1 O00255 2/20 0.57
KMT2A Q03164 2/20 0.57
LMNA P02545 5/20 0.56
TSHR P16473 2/20 0.54
CYP1A2 P05177 1/20 0.54
CYP3A4 P08684 1/20 0.54
PKM P14618 1/20 0.54
CYP2C19 P33261 1/20 0.54
MAPK1 P28482 1/20 0.52
GAA P10253 1/20 0.52
L3MBTL1 Q9Y468 1/20 0.52

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
SCHEMBL6140448 0.87 SMN1; SMN2 (0.57) CA12CA9GPR27AVPR2HTT
SCHEMBL8752463 0.84 CA12 (1.00) CA12CA9HTTALDH1A1SMN1; SMN2
SCHEMBL10947961 0.81 CA12 (0.76) CA12CA9HTTALDH1A1SMN1; SMN2
SCHEMBL3046360 0.79 CA12 (0.78) CA12CA9HTTALDH1A1SMN1; SMN2
SCHEMBL6809700 0.78 CA12 (0.76) CA12CA9HTTALDH1A1SMN1; SMN2
SCHEMBL10740742 0.77 GAA (0.54) CA12CA9ALDH1A1SMN1; SMN2KDM4E
SCHEMBL12505411 0.77 SMN1; SMN2 (0.53) ALDH1A1SMN1; SMN2KDM4EHSD17B10LMNA
SCHEMBL633327 0.77 CA12 (0.83) CA12CA9HTTALDH1A1SMN1; SMN2
SCHEMBL6792745 0.77 CA12 (0.74) CA12CA9HTTALDH1A1SMN1; SMN2
SCHEMBL6108804 0.77 MCHR1 (0.60) CA12CA9GPR27AVPR2LMNA

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