SCHEMBL7075168

SCHEMBL7075168

N=CCNCC/C(F)=C/C[C@@](N)(CF)C(=O)O

nearest known ligand 0.33

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
ODC1 P11926 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
SCHEMBL7075163 1.00 ODC1 (0.33) ODC1
SCHEMBL7072471 1.00 ODC1 (0.33) ODC1
SCHEMBL7068647 0.88 MEN1 (0.36)
SCHEMBL7068645 0.88 MEN1 (0.36)
SCHEMBL7071337 0.85 NOS1 (0.31)
SCHEMBL7071494 0.85 NOS1 (0.31)
SCHEMBL7069214 0.82
SCHEMBL7072464 0.82
SCHEMBL7069212 0.82
SCHEMBL7544497 0.78 ODC1 (0.33) ODC1

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 claimed
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 claimed