SCHEMBL2654802

SCHEMBL2654802

Cc1cc(OCC(C)(C)CCCc2ccc(C(=O)NCCC(=O)O)cc2)cc(C)c1-c1ccc(C(C)C)cc1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 17/20 0.54
▸ NPC1 O15118 1/20 0.46
▸ RAB9A P51151 1/20 0.46
▸ SMN1; SMN2 Q16637 1/20 0.46
▸ GIPR P48546 4/20 0.43
▸ GCG P01275 1/20 0.42
▸ ADCY6 O43306 1/20 0.41
▸ ADCY3 O60266 1/20 0.41
▸ ADCY9 O60503 1/20 0.41
▸ ADCY5 O95622 1/20 0.41
▸ ADCY8 P40145 1/20 0.41
▸ ADCY7 P51828 1/20 0.41
▸ ADCY2 Q08462 1/20 0.41
▸ ADCY1 Q08828 1/20 0.41
▸ ADCY4 Q8NFM4 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
SCHEMBL2654661 0.95 GCGR (0.55) GCGRNPC1RAB9ASMN1; SMN2GIPR
SCHEMBL2655159 0.93 GCGR (0.46) GCGRNPC1RAB9ASMN1; SMN2GIPR
SCHEMBL2655470 0.92 GCGR (0.49) GCGRSMN1; SMN2GIPRGCGADCY6
SCHEMBL2654807 0.90 GCGR (0.45) GCGRNPC1RAB9ASMN1; SMN2GIPR
SCHEMBL2654727 0.89 GCGR (0.55) GCGRGIPRGCG
SCHEMBL2653229 0.87 GCGR (0.47) GCGRNPC1RAB9ASMN1; SMN2GIPR
SCHEMBL2655611 0.85 GCGR (0.60) GCGRNPC1RAB9AGIPRADCY6
SCHEMBL2653412 0.84 PSEN1 (0.44) GCGRNPC1RAB9ASMN1; SMN2
SCHEMBL2653584 0.84 GCGR (0.56) GCGRGIPRGCG
SCHEMBL2653405 0.83 GCGR (0.53) GCGRNPC1RAB9ASMN1; SMN2GIPR

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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