SCHEMBL7072151

SCHEMBL7072151

N=CCNCCC=CCC(N)(CF)C(=O)O

nearest known ligand 0.35

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 1/20 0.35

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
SCHEMBL7071604 1.00 ODC1 (0.35) ODC1
SCHEMBL7071104 0.86 MEN1 (0.36)
SCHEMBL7067315 0.86 MEN1 (0.36)
SCHEMBL7075158 0.82 NOS1 (0.33)
SCHEMBL7071571 0.82 NOS1 (0.33)
SCHEMBL7067866 0.79 GGT1 (0.31)
SCHEMBL6472209 0.79 GGT1 (0.31)
SCHEMBL7074563 0.79 GGT1 (0.31)
SCHEMBL7067880 0.79 GGT1 (0.31)
SCHEMBL7071320 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