SCHEMBL2654807

SCHEMBL2654807

Cc1cc(OCC(C)(C)CCCc2ccc(C(=O)NCCC(=O)O)cc2)cnc1-c1ccc(C(C)C)cc1

nearest known ligand 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 14/20 0.45
▸ NPC1 O15118 1/20 0.44
▸ RAB9A P51151 1/20 0.44
▸ SMN1; SMN2 Q16637 1/20 0.44
▸ GCG P01275 4/20 0.43
▸ GIPR P48546 1/20 0.41

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
SCHEMBL2656558 0.90 GCGR (0.45) GCGRGCGGIPR
SCHEMBL2654802 0.90 GCGR (0.54) GCGRNPC1RAB9ASMN1; SMN2GCG
SCHEMBL2654724 0.88 GCGR (0.50) GCGRGIPR
SCHEMBL2655085 0.85 GCGR (0.46) GCGRGCGGIPR
SCHEMBL2655675 0.85 GCG (0.47) GCGRNPC1RAB9ASMN1; SMN2GCG
SCHEMBL2654661 0.84 GCGR (0.55) GCGRNPC1RAB9ASMN1; SMN2GCG
SCHEMBL2655159 0.82 GCGR (0.46) GCGRNPC1RAB9ASMN1; SMN2GIPR
SCHEMBL2655470 0.81 GCGR (0.49) GCGRSMN1; SMN2GCGGIPR
SCHEMBL1765327 0.81 GCGR (0.59) GCGRGCG
SCHEMBL2654727 0.79 GCGR (0.55) GCGRGCGGIPR

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
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