SCHEMBL7980455

SCHEMBL7980455

CNC(=O)[C@](F)(CCCCN)N(F)F

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PAOX Q6QHF9 3/20 0.32
FDPS P14324 2/20 0.32
HDAC6 Q9UBN7 1/20 0.30
ODC1 P11926 1/20 0.30

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
SCHEMBL6151308 0.78 ODC1 (0.41) FDPSHDAC6ODC1
SCHEMBL6151309 0.78 ODC1 (0.41) FDPSHDAC6ODC1
SCHEMBL24850792 0.71 PAOX (0.39) PAOXFDPS
SCHEMBL5069038 0.69 CHRM2 (0.40) PAOXFDPSHDAC6ODC1
SCHEMBL7940896 0.66 ODC1 (0.44) FDPSHDAC6ODC1
SCHEMBL29001334 0.64 ODC1 (0.43) PAOXFDPSHDAC6ODC1
SCHEMBL6567609 0.63 ODC1 (0.37) PAOXFDPSHDAC6ODC1
SCHEMBL7924611 0.63 ODC1 (0.37) PAOXFDPSHDAC6ODC1
SCHEMBL15001263 0.62 MEN1 (0.32) FDPS
SCHEMBL21026756 0.62

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
US-6281352-B1 ANTIINFLAMMATORY AGENTS DUPONT PHARMACEUTICALS COMPANY 2001-08-28 US disclosed