SCHEMBL8240286

SCHEMBL8240286

CC(C)(C)[C@H](N)CN1CCCOC1=O

nearest known ligand 0.63

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 3/20 0.63
PER2 O15055 2/20 0.40
CRY2 Q49AN0 2/20 0.40
GRM2 Q14416 2/20 0.37
GRIN1 Q05586 4/20 0.34
GRIN2B Q13224 4/20 0.34

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
SCHEMBL8283594 0.90 PIK3CD (0.49) PIK3CDPER2CRY2GRM2
SCHEMBL13804489 0.78 PIK3CD (0.59) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL8282897 0.78 PIK3CD (1.00) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL13791864 0.77 PIK3CD (0.62) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL12228958 0.75 PIK3CD (0.59) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL8239457 0.75 SMN1; SMN2 (0.43) PIK3CDPER2CRY2GRIN1GRIN2B
SCHEMBL13622786 0.75 PIK3CD (0.55) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL8282119 0.75 PIK3CD (0.55) PIK3CDPER2CRY2GRM2GRIN1
SCHEMBL8250636 0.75 PIK3CD (0.59) PIK3CDPER2
SCHEMBL4126996 0.75 PIK3CD (0.59) PIK3CDPER2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730142-B1 NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS SCHERING CORP (US) 2011-06-29 EP disclosed
WO-2006130686-A2 HCV PROTEASE INHIBITORS IN COMBINATION WITH FOOD SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130553-A2 HCV PROTEASE INHIBITORS SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130687-A2 LIVER/PLASMA CONCENTRATION RATIO FOR DOSING HEPATITIS C VIRUS PROTEASE INHIBITOR SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130607-A2 CONTROLLED-RELEASE FORMULATION USEFUL FOR TREATING DISORDERS ASSOCIATED WITH HEPATITIS C VIRUS SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130552-A2 METHODS OF TREATING HEPATITIS C VIRUS SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130688-A2 COMPOUNDS FOR INHIBITING CATHEPSIN ACTIVITY SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130554-A2 METHODS OF TREATING HEPATITIS C VIRUS SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2006130627-A2 METHODS FOR TREATING HEPATITIS C SCHERING CORPORATION (US) 2006-12-07 WO disclosed
WO-2005085242-A1 NOVEL KETOAMIDES WITH CYCLIC P4'S AS INHIBITORS OF NS3 SERINE PROTEASE OF HEPATITIS C VIRUS SCHERING CORPORATION (US) 2005-09-15 WO disclosed