SCHEMBL7075158

SCHEMBL7075158

COCC(N)(CC=CCCNCC=N)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NOS1 P29475 1/20 0.33
NOS2 P35228 1/20 0.33

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
SCHEMBL7071571 1.00 NOS1 (0.33) NOS1NOS2
SCHEMBL7071104 0.85 MEN1 (0.36)
SCHEMBL7067315 0.85 MEN1 (0.36)
SCHEMBL7072151 0.82 ODC1 (0.35)
SCHEMBL7071604 0.82 ODC1 (0.35)
SCHEMBL7071568 0.80 NOS1 (0.33) NOS1NOS2
SCHEMBL6987908 0.80 NOS1 (0.33) NOS1NOS2
SCHEMBL6472209 0.79 GGT1 (0.31)
SCHEMBL7067866 0.79 GGT1 (0.31)
SCHEMBL7067880 0.79 GGT1 (0.31)

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-1317418-A2 2-AMINO-2-ALKYL-4 HEPTENOIC AND HEPTYNOIC ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS Pharmacia Corporation (US) 2003-06-11 EP disclosed
WO-2002022557-A2 2-AMINO-2-ALKYL-4 HEPTENOIC AND HEPTYNOIC ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS PHARMACIA CORPORATION (US) 2002-03-21 WO disclosed