SCHEMBL2654697

SCHEMBL2654697

Cc1cc(OCC(C)CCc2ccc(C(=O)NCCC(=O)O)cc2)cc(C)c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.55

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.55
GIPR P48546 3/20 0.45
GCG P01275 4/20 0.45
CHRM5 P08912 1/20 0.45
GLP1R P43220 1/20 0.45
PPARD Q03181 1/20 0.42
PPARA Q07869 1/20 0.42

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
SCHEMBL2656116 0.92 GCGR (0.55) GCGRGIPRGCGCHRM5GLP1R
SCHEMBL2655056 0.92 GCGR (0.47) GCGRGIPRGCGCHRM5GLP1R
SCHEMBL2655617 0.92 GCGR (0.61) GCGR
SCHEMBL2656188 0.92 GCGR (0.52) GCGRGIPR
SCHEMBL2655892 0.91 GCGR (0.46) GCGRGIPRGCGGLP1RPPARD
SCHEMBL2655024 0.91 GCGR (0.51) GCGRGCG
SCHEMBL2653527 0.91 GCGR (0.55) GCGRGIPRGCGCHRM5GLP1R
SCHEMBL2657098 0.90 GCGR (0.49) GCGRGIPRGCG
SCHEMBL2655144 0.90 GCGR (0.49) GCGRGCG
SCHEMBL2656273 0.90 GCGR (0.54) GCGRGIPRGCGCHRM5GLP1R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1758853-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP claimed
WO-2005123668-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-29 WO claimed
EP-1758853-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 EP disclosed
WO-2005123668-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-29 WO disclosed