SCHEMBL3926164

SCHEMBL3926164

CC1(C)CCC(N[C@@H](CCC(=O)O)C(=O)O)CC1

nearest known ligand 0.57

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.57
BLM P54132 1/20 0.57
FOLH1 Q04609 4/20 0.43
NAALAD2 Q9Y3Q0 2/20 0.43
RIMKLA Q8IXN7 1/20 0.43
GGH Q92820 1/20 0.41
CCKBR P32239 2/20 0.39
EPHX2 P34913 2/20 0.38

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
SCHEMBL3926158 1.00 LMNA (0.57) LMNABLMFOLH1NAALAD2RIMKLA
SCHEMBL8647821 0.88 BLM (0.48) LMNABLMFOLH1CCKBREPHX2
SCHEMBL10935612 0.85 FOLH1 (0.53) FOLH1NAALAD2RIMKLAGGHEPHX2
SCHEMBL10935609 0.85 FOLH1 (0.53) FOLH1NAALAD2RIMKLAGGHEPHX2
SCHEMBL29501687 0.80 EPHX2 (0.53) LMNAFOLH1NAALAD2RIMKLAGGH
SCHEMBL1352750 0.77 LMNA (0.49) LMNABLMEPHX2
Hydrochloric Acid SCHEMBL28923980 0.77 LMNA (0.40) LMNABLMEPHX2
SCHEMBL1352747 0.77 LMNA (0.49) LMNABLMEPHX2
SCHEMBL1352745 0.77 LMNA (0.49) LMNABLMEPHX2
SCHEMBL3913759 0.75 LMNA (0.47) LMNABLMEPHX2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1940376-A2 USE OF NEBOGLAMINE IN THE TREATMENT OF TOXICODEPENDENCY ROTTAPHARM S.P.A. (IT) 2008-07-09 EP claimed
WO-2007039869-A2 USE OF NEBOGLAMINE IN THE TREATMENT OF TOXICODEPENDENCY ROTTAPHARM S.P.A. (IT) 2007-04-12 WO claimed
EP-1940376-B1 USE OF NEBOGLAMINE IN THE TREATMENT OF TOXICODEPENDENCY ROTTAPHARM SPA (IT) 2009-03-18 EP disclosed
EP-1940376-A2 USE OF NEBOGLAMINE IN THE TREATMENT OF TOXICODEPENDENCY ROTTAPHARM S.P.A. (IT) 2008-07-09 EP disclosed
WO-2007039869-A3 USE OF NEBOGLAMINE IN THE TREATMENT OF TOXICODEPENDENCY ROTTAPHARM SPA (IT) 2007-07-05 WO disclosed
WO-2007039869-A2 USE OF NEBOGLAMINE IN THE TREATMENT OF TOXICODEPENDENCY ROTTAPHARM S.P.A. (IT) 2007-04-12 WO disclosed