SCHEMBL381099

SCHEMBL381099

CCCCNC(=O)Oc1cccc(-c2oc(C)cc2C(N)=O)c1.N=C=O

nearest known ligand 0.91

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
FAAH O00519 9/20 0.70
DRD2 P14416 2/20 0.63
DRD3 P35462 2/20 0.63
KCNH2 Q12809 1/20 0.63
MGLL Q99685 3/20 0.59

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
SCHEMBL12804230 0.95 FAAH (0.76) FAAHDRD2DRD3KCNH2MGLL
SCHEMBL381279 0.84 FAAH (0.63) FAAHDRD2DRD3KCNH2MGLL
SCHEMBL382462 0.82 FAAH (1.00) FAAHDRD2DRD3KCNH2MGLL
SCHEMBL381098 0.78 FAAH (0.51) FAAHDRD2DRD3KCNH2MGLL
SCHEMBL381413 0.77 FAAH (0.60) FAAHDRD2DRD3KCNH2MGLL
SCHEMBL381742 0.73 FAAH (0.55) FAAHDRD2DRD3KCNH2MGLL
SCHEMBL14329550 0.73 ALDH1A1 (0.64)
SCHEMBL381681 0.73 FAAH (0.69) FAAHMGLL
SCHEMBL12017703 0.71 FAAH (0.88) FAAHDRD3MGLL
SCHEMBL10242942 0.71 PTGS2 (0.54) FAAHMGLL

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-2408743-A1 CARBAMATE DERIVATIVES IN PARTICULAR FOR THE TREATMENT OF NEUROLOGICAL DISORDERS SIGMA-TAU Industrie Farmaceutiche Riunite S.p.A. (IT) 2012-01-25 EP disclosed
WO-2010105930-A1 CARBAMATE DERIVATIVES IN PARTICULAR FOR THE TREATMENT OF NEUROLOGICAL DISORDERS SIGMA-TAU INDUSTRIE FARMACEUTICHE RIUNITE S.P.A. (IT) 2010-09-23 WO disclosed