SCHEMBL11517100

SCHEMBL11517100

O=C(CC(=O)C(F)(F)C(F)F)C(F)(F)C(F)F

nearest known ligand 0.43

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.43

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
SCHEMBL11516189 0.85 PKM (0.38) PKM
SCHEMBL20878763 0.81 TDP1 (0.38) PKM
SCHEMBL810588 0.78 PKM (0.35) PKM
SCHEMBL898175 0.76 GAA (0.52)
SCHEMBL23009377 0.74 PIK3CD (0.32)
SCHEMBL10584882 0.74 PKM (0.33) PKM
SCHEMBL865265 0.71
SCHEMBL11674335 0.71 PKM (0.42) PKM
SCHEMBL1834849 0.71 PKM (0.54) PKM
SCHEMBL5728396 0.69

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-4180386-A ANTIKNOCK FUEL ADDITIVES E. I. DU PONT DE NEMOURS & COMPANY (US) 1979-12-25 US disclosed