SCHEMBL6098840

SCHEMBL6098840

Cc1nnsc1C(=O)N(C)c1ccc(C(Cc2ccccc2F)c2nc3c([nH]2)c(=O)[nH]c(=O)n3CC2CC2)cc1

nearest known ligand 0.36

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PCK1 P35558 10/20 0.36
ATM Q13315 1/20 0.33
GAA P10253 1/20 0.31
TDP1 Q9NUW8 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
SCHEMBL6096610 0.91 PCK1 (0.36) PCK1
SCHEMBL6097928 0.89 PCK1 (0.39) PCK1
SCHEMBL3981838 0.87 PCK1 (0.35) PCK1
SCHEMBL3982926 0.86 PCK1 (0.36) PCK1
SCHEMBL6098692 0.85 PCK1 (0.36) PCK1
SCHEMBL6096021 0.85 PCK1 (0.38) PCK1TDP1
SCHEMBL6097396 0.85 PCK1 (0.36) PCK1
SCHEMBL3978805 0.85 PCK1 (0.38) PCK1
SCHEMBL3978694 0.84 PCK1 (0.37) PCK1
SCHEMBL6098947 0.84 PCK1 (0.37) 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
US-7135475-B2 Antidiabetic agents HOFFMANN-LA ROCHE INC. (US) 2006-11-14 US claimed