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SCHEMBL2665060

SCHEMBL2665060

O=C(O)CCNC(=O)c1ccc(C(=O)C(CC(=O)c2ccc3c(c2)C(F)(F)OC(F)(F)O3)c2ccc(C3CCCCC3)cc2)cc1

nearest known ligand 0.37

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ GCGR P47871 11/20 0.37
▸ CYP2D6 P10635 1/20 0.37
▸ DHODH Q02127 1/20 0.36
▸ GIPR P48546 2/20 0.35
▸ EPHX2 P34913 1/20 0.34
▸ PPARD Q03181 1/20 0.33
▸ GCG P01275 3/20 0.33
▸ OPRM1 P35372 1/20 0.33
▸ OPRK1 P41145 1/20 0.33
▸ HAO1 Q9UJM8 1/20 0.32

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
SCHEMBL6917335 0.87 DHODH (0.39) GCGRCYP2D6DHODHGIPREPHX2
SCHEMBL2653731 0.83 HAO1 (0.46) GCGRCYP2D6EPHX2PPARDHAO1
SCHEMBL2648396 0.83 MAPK9 (0.48) GCGRCYP2D6
SCHEMBL2665203 0.83 GCGR (0.48) GCGRCYP2D6GIPREPHX2
SCHEMBL2652858 0.81 EPHX2 (0.41) GCGRCYP2D6DHODHGIPREPHX2
SCHEMBL2660761 0.80 GCGR (0.43) GCGRCYP2D6DHODHGIPRGCG
SCHEMBL2651641 0.79 PPARD (0.47) GCGRGIPRPPARDGCG
SCHEMBL2652188 0.79 PPARD (0.47) GCGRGIPRPPARDGCG
SCHEMBL2647399 0.79 PPARD (0.47) GCGRGIPRPPARDGCG
SCHEMBL2665081 0.79 GCGR (0.49) GCGRCYP2D6GIPR

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-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 — — WO disclosed