SCHEMBL4060976

SCHEMBL4060976

O=C(O)N1CCC2(CC1)CN(C1CC1)C2

nearest known ligand 0.42

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HRH3 Q9Y5N1 18/20 0.42
L3MBTL3 Q96JM7 2/20 0.37
L3MBTL1 Q9Y468 2/20 0.37

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
SCHEMBL4063194 0.91 HRH3 (0.44) HRH3L3MBTL3L3MBTL1
SCHEMBL2521200 0.86 HRH3 (0.41) HRH3L3MBTL3L3MBTL1
SCHEMBL4072607 0.85 HRH3 (0.47) HRH3L3MBTL3L3MBTL1
SCHEMBL21590841 0.82 HRH3 (0.35) HRH3L3MBTL3L3MBTL1
SCHEMBL484973 0.81 HRH3 (0.43) HRH3L3MBTL3L3MBTL1
SCHEMBL484635 0.81 HRH3 (0.36) HRH3L3MBTL3L3MBTL1
SCHEMBL4130400 0.80 HRH3 (0.54) HRH3
SCHEMBL4060980 0.78 HRH3 (0.35) HRH3L3MBTL3L3MBTL1
SCHEMBL21981370 0.76 HRH3 (0.41) HRH3L3MBTL3L3MBTL1
SCHEMBL29976531 0.75 ITGB3 (0.42) HRH3L3MBTL3L3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2032535-B1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS SANOFI SA (FR) 2012-08-01 EP claimed
EP-2032535-A1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS Sanofi-Aventis (FR) 2009-03-11 EP claimed
WO-2007137738-A1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS SANOFI-AVENTIS (DE) 2007-12-06 WO claimed
EP-2520568-A1 Spirocyclic nitriles as inhibitors of protease SANOFI (FR) 2012-11-07 EP disclosed
EP-2032535-B1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS SANOFI SA (FR) 2012-08-01 EP disclosed
EP-2032535-A1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS Sanofi-Aventis (FR) 2009-03-11 EP disclosed
WO-2007137738-A1 SPIROCYCLIC NITRILES AS PROTEASE INHIBITORS SANOFI-AVENTIS (DE) 2007-12-06 WO disclosed