SCHEMBL28899744

SCHEMBL28899744

CCOc1cccc(Nc2ccc([N+](=O)[O-])c3[nH]c(C(=O)O)cc23)c1

nearest known ligand 0.80

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
FBP1 P09467 20/20 0.80

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
SCHEMBL28471004 0.91 FBP1 (0.69) FBP1
SCHEMBL28168913 0.89 FBP1 (1.00) FBP1
SCHEMBL28455661 0.85 FBP1 (0.79) FBP1
SCHEMBL28169371 0.85 FBP1 (0.76) FBP1
SCHEMBL28471007 0.85 FBP1 (0.77) FBP1
SCHEMBL28467754 0.84 FBP1 (1.00) FBP1
SCHEMBL28168955 0.83 FBP1 (0.82) FBP1
SCHEMBL28899740 0.83 FBP1 (0.78) FBP1
SCHEMBL28467683 0.83 FBP1 (0.74) FBP1
SCHEMBL28465567 0.83 FBP1 (0.78) FBP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107098846-B N-acyl sulfonamide FBPase inhibitor, preparation method thereof, pharmaceutical composition and application thereof 中国医学科学院药物研究所 2020-10-09 CN disclosed