SCHEMBL2654644

SCHEMBL2654644

CC(COc1ccc(-c2ccc(C(F)(F)F)nc2)cc1)Cc1ccc(C(=O)NCCC(=O)O)cc1

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ GCG P01275 2/20 0.47
▸ GCGR P47871 18/20 0.47
▸ ADCY6 O43306 1/20 0.44
▸ ADCY3 O60266 1/20 0.44
▸ ADCY9 O60503 1/20 0.44
▸ ADCY5 O95622 1/20 0.44
▸ ADCY8 P40145 1/20 0.44
▸ ADCY7 P51828 1/20 0.44
▸ ADCY2 Q08462 1/20 0.44
▸ ADCY1 Q08828 1/20 0.44
▸ ADCY4 Q8NFM4 1/20 0.44
▸ GIPR P48546 2/20 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
SCHEMBL2654634 0.91 GCGR (0.48) GCGGCGR
SCHEMBL2653550 0.89 GCGR (0.49) GCGGCGRADCY6ADCY3ADCY9
SCHEMBL2653428 0.84 GCGR (0.58) GCGGCGRADCY6ADCY3ADCY9
SCHEMBL2653054 0.83 CA12 (0.42) GCGGCGR
SCHEMBL1765745 0.81 GCGR (0.65) GCGGCGRADCY6ADCY3ADCY9
SCHEMBL2654579 0.81 PPARD (0.43) GCGRADCY6ADCY3ADCY9ADCY5
SCHEMBL2654147 0.80 FFAR1 (0.48) GCGGCGRGIPR
SCHEMBL1765587 0.80 GCGR (0.66) GCGGCGR
SCHEMBL2654059 0.79 GCGR (0.50) GCGGCGRADCY6ADCY3ADCY9
SCHEMBL2653527 0.79 GCGR (0.55) GCGGCGRADCY6ADCY3ADCY9

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 2 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 disclosed
WO-2005123668-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-29 — — WO disclosed
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