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Sugi Predict / Compounds / SCHEMBL2659784

SCHEMBL2659784

SCHEMBL2659784

CCCCCC(Oc1ccc(C(=O)NCCC(=O)OC(C)(C)C)cc1)c1ccc(-c2ccccc2C(F)(F)F)nc1.CCCCCC(Oc1ccc(C(=O)NCCC(=O)OC(C)(C)C)cc1)c1ccc(Cl)nc1

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 16/20 0.42
▸ GCG P01275 8/20 0.40
▸ GLP1R P43220 1/20 0.39
▸ GIPR P48546 1/20 0.39

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
SCHEMBL2276366 0.96 GCGR (0.45) GCGRGCGGLP1RGIPR
SCHEMBL2274509 0.96 GCGR (0.45) GCGRGCGGLP1RGIPR
SCHEMBL2658969 0.93 GCGR (0.49) GCGRGCGGLP1RGIPR
SCHEMBL2270536 0.89 GCGR (0.48) GCGRGCG
SCHEMBL2269786 0.89 GCGR (0.48) GCGRGCG
SCHEMBL2273240 0.87 GCGR (0.55) GCGRGCGGLP1RGIPR
SCHEMBL2273245 0.87 GCGR (0.55) GCGRGCGGLP1RGIPR
SCHEMBL2274068 0.82 GCG (0.51) GCGRGCG
SCHEMBL2274379 0.81 GCGR (0.51) GCGRGCGGLP1RGIPR
SCHEMBL2274376 0.81 GCGR (0.51) GCGRGCGGLP1RGIPR

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-1758859-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-03-07 — — EP disclosed
WO-2005118542-A1 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2005-12-15 — — WO disclosed