SCHEMBL2666436

SCHEMBL2666436

C=C(NCCC(=O)O)c1ccc(C(CC(=O)c2ccc(Cl)c(Cl)c2)C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)cc1

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KMO O15229 3/20 0.38
▸ GCGR P47871 6/20 0.36
▸ RHOC P08134 1/20 0.36
▸ RHOA P61586 1/20 0.36
▸ TACR1 P25103 2/20 0.35
▸ GIPR P48546 1/20 0.35

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
SCHEMBL2656002 0.91 RHOC (0.43) GCGRRHOCRHOAGIPR
SCHEMBL2666468 0.81 KMO (0.37) KMO
SCHEMBL2655272 0.79 ALDH1A1 (0.47) GCGRTACR1
SCHEMBL2666460 0.79 GCGR (0.38) GCGRGIPR
SCHEMBL2652488 0.78 FABP4 (0.45) KMOGCGR
SCHEMBL2666432 0.78 GCGR (0.44) GCGR
SCHEMBL6755575 0.77 GCGR (0.51) GCGR
SCHEMBL2660882 0.77 GCG (0.43) GCGRRHOCRHOATACR1GIPR
SCHEMBL2654576 0.77 GCGR (0.51) GCGRGIPR
SCHEMBL2652726 0.77 GCG (0.45) GCGRGIPR

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
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