SCHEMBL6991638

SCHEMBL6991638

CC(N)(CC(F)=C(F)CNCC=N)C(=O)O

nearest known ligand 0.31

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GGT1 P19440 1/20 0.31

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
SCHEMBL6990515 0.85 GGT1 (0.36) GGT1
SCHEMBL6993638 0.85 GGT1 (0.36) GGT1
SCHEMBL6987418 0.85 GGT1 (0.36) GGT1
SCHEMBL6991106 0.80 GGT1 (0.34) GGT1
SCHEMBL6991109 0.80 GGT1 (0.34) GGT1
SCHEMBL6988836 0.80 GGT1 (0.34) GGT1
SCHEMBL6990294 0.79 GGT1 (0.31) GGT1
SCHEMBL6985108 0.78 GGT1 (0.33) GGT1
SCHEMBL6993512 0.78 GGT1 (0.33) GGT1
SCHEMBL6985494 0.78 GGT1 (0.30) GGT1

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-1317416-A2 2-AMINO-2-ALKYL-4 HEXENOIC AND HEXYNOIC ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS Pharmacia Corporation (US) 2003-06-11 EP claimed
WO-2002022559-A2 2-AMINO-2-ALKYL-4 HEXENOIC AND HEXYNOIC ACID DERIVATIVES USEFUL AS NITRIC OXIDE SYNTHASE INHIBITORS PHARMACIA CORPORATION (US) 2002-03-21 WO claimed