SCHEMBL2655857

SCHEMBL2655857

CCOC(=O)CCNC(=O)c1ccc(CC(C)CCOc2cc(C)c(-c3ccc(C(F)(F)F)cc3)c(C)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GCGR P47871 5/20 0.46
EPHX2 P34913 5/20 0.44
PPARG P37231 5/20 0.44
MAPT P10636 1/20 0.42
SMN1; SMN2 Q16637 2/20 0.42
GCG P01275 3/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
PPARA Q07869 2/20 0.38
PPARD Q03181 2/20 0.38
CHRM5 P08912 1/20 0.38
GLP1R P43220 1/20 0.38

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
SCHEMBL2656634 0.93 GCGR (0.50) GCGREPHX2MAPTSMN1; SMN2NPC1
SCHEMBL2655051 0.91 GCGR (0.55) GCGRGCGPPARAPPARDCHRM5
SCHEMBL2653285 0.87 GCGR (0.45) GCGRMAPTSMN1; SMN2NPC1PPARA
SCHEMBL2654932 0.86 GCGR (0.46) GCGRMAPTGCGPPARAPPARD
SCHEMBL2656547 0.84 MAPT (0.48) EPHX2MAPTSMN1; SMN2NPC1
SCHEMBL2653091 0.84 GCGR (0.53) GCGRGCGCHRM5GLP1R
SCHEMBL2656116 0.83 GCGR (0.55) GCGRGCGPPARAPPARDCHRM5
SCHEMBL2655997 0.83 GCGR (0.61) GCGREPHX2GCGNPC1RAB9A
SCHEMBL2655853 0.82 GCGR (0.49) GCGRMAPTSMN1; SMN2GCGNPC1
SCHEMBL2653527 0.82 GCGR (0.55) GCGRGCGPPARAPPARDCHRM5

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-1951659-A2 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES Eli Lilly & Company (US) 2008-08-06 EP disclosed
WO-2007114855-A2 GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-10-11 WO disclosed