SCHEMBL6170997

SCHEMBL6170997

NC(=O)C1CCCN1Cc1ccc(OCc2cccc(Cl)c2)cc1Cl

nearest known ligand 0.73

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MAOB P27338 12/20 0.73
MAOA P21397 10/20 0.73
SPHK1 Q9NYA1 2/20 0.64
SCN3A Q9NY46 1/20 0.55
SPHK2 Q9NRA0 2/20 0.53
S1PR1 P21453 1/20 0.48
PRKX P51817 1/20 0.48
ACVR1 Q04771 1/20 0.48
S1PR5 Q9H228 1/20 0.48

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
SCHEMBL6170993 1.00 MAOB (0.73) MAOBMAOASPHK1SCN3ASPHK2
SCHEMBL21348014 0.91 MAOB (0.89) MAOBMAOASPHK1SCN3A
SCHEMBL6167507 0.89 MAOB (0.79) MAOBMAOASPHK1SCN3ASPHK2
SCHEMBL6167500 0.89 MAOB (0.79) MAOBMAOASPHK1SCN3ASPHK2
SCHEMBL6168060 0.88 MAOB (0.70) MAOBMAOASPHK1SCN3AS1PR1
SCHEMBL6168052 0.88 MAOB (0.70) MAOBMAOASPHK1SCN3AS1PR1
SCHEMBL6167377 0.88 SPHK1 (0.76) MAOBMAOASPHK1SCN3ASPHK2
SCHEMBL6167379 0.88 SPHK1 (0.76) MAOBMAOASPHK1SCN3ASPHK2
SCHEMBL6171245 0.86 MAOB (0.74) MAOBMAOASPHK1SCN3ASPHK2
SCHEMBL6171239 0.86 MAOB (0.74) MAOBMAOASPHK1SCN3ASPHK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005040108-A1 PROLINAMIDE DERIVATIVES AS SODIUM AND/OR CALCIUM CHANNEL BLOCKERS OR SELECTIVE MAO-B INHIBITORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2005-05-06 WO claimed
EP-1524265-A1 Prolinamide derivatives as sodium and/or calcium channel blockers or selective MAO-B inhibitors Newron Pharmaceuticals S.p.A. (IT) 2005-04-20 EP claimed
WO-2005040108-A1 PROLINAMIDE DERIVATIVES AS SODIUM AND/OR CALCIUM CHANNEL BLOCKERS OR SELECTIVE MAO-B INHIBITORS NEWRON PHARMACEUTICALS S.P.A. (IT) 2005-05-06 WO disclosed
EP-1524265-A1 Prolinamide derivatives as sodium and/or calcium channel blockers or selective MAO-B inhibitors Newron Pharmaceuticals S.p.A. (IT) 2005-04-20 EP disclosed