SCHEMBL2666485

SCHEMBL2666485

O=C(O)CCNC(=O)c1ccc(N(Cc2ccc(C3CCCCC3)cc2)C(=O)NCCC(c2ccccc2)c2ccccc2)cc1

nearest known ligand 0.63

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCGR P47871 13/20 0.63
GIPR P48546 9/20 0.52
STAT3 P40763 3/20 0.49
OPRM1 P35372 1/20 0.47
OPRK1 P41145 1/20 0.47
GLP1R P43220 3/20 0.46
EPHX2 P34913 1/20 0.45
CYP2D6 P10635 1/20 0.43
TPSAB1 Q15661 1/20 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
SCHEMBL4087809 0.88 GCGR (0.61) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL4081881 0.88 GCGR (0.61) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL2663366 0.88 GCGR (0.61) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL9070861 0.83 GCGR (0.65) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL6755480 0.83 GCGR (0.65) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL2650887 0.83 GCGR (0.59) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL2663310 0.83 GCGR (0.61) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL2653321 0.82 GCGR (0.61) GCGRGIPRSTAT3OPRM1OPRK1
SCHEMBL2660467 0.82 GCGR (0.73) GCGRGIPRGLP1R
SCHEMBL2663249 0.82 GCGR (0.62) GCGRGIPRSTAT3OPRM1OPRK1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2004056763-A2 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2004-07-08 WO disclosed