SCHEMBL3983015

SCHEMBL3983015

Cc1nc(N)sc1OC(=O)N(C)c1ccc(C(Cc2ccccc2F)c2nc3c([nH]2)c(=O)[nH]c(=O)n3CC2CC2)cc1

nearest known ligand 0.38

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PCK1 P35558 7/20 0.38

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
SCHEMBL3977678 0.94 PCK1 (0.35) PCK1
SCHEMBL6097928 0.89 PCK1 (0.39) PCK1
SCHEMBL3987363 0.86 PCK1 (0.35) PCK1
SCHEMBL4299310 0.85 PCK1 (0.35) PCK1
SCHEMBL6096610 0.84 PCK1 (0.36) PCK1
SCHEMBL3978694 0.83 PCK1 (0.37) PCK1
SCHEMBL3980021 0.83 PCK1 (0.34) PCK1
SCHEMBL3978683 0.82 PCK1 (0.36) PCK1
SCHEMBL6098840 0.82 PCK1 (0.36) PCK1
SCHEMBL3982926 0.81 PCK1 (0.36) PCK1

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
EP-1515972-B1 AMIDE SUBSTITUTED XANTHINE DERIVATIVES WITH GLUCONEOGENESIS MODULATING ACTIVITY HOFFMANN LA ROCHE (CH) 2009-05-13 EP claimed