SCHEMBL9070985

SCHEMBL9070985

N=C(Nc1cc(Br)cc(C(F)(F)F)c1)N(Cc1ccc(C(=O)Nc2nn[nH]n2)cc1)c1ccc(C2=CCCCC2)cc1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCGR P47871 18/20 0.60
GIPR P48546 17/20 0.60
GLP1R P43220 4/20 0.42
GCG P01275 1/20 0.41
MGAT2 Q10469 2/20 0.40

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
SCHEMBL9070987 0.95 GCGR (0.53) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL2663209 0.94 GCGR (0.68) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL2665451 0.89 GCGR (0.56) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL2665383 0.89 GCGR (0.56) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL2665413 0.89 GCGR (0.55) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL2663371 0.88 GCGR (0.61) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL13799988 0.88 GCGR (0.53) GCGRGIPRGLP1RGCGMGAT2
SCHEMBL9070983 0.86 GCGR (0.51) GCGRGIPRGCG
SCHEMBL13800855 0.86 GCGR (0.57) GCGRGIPRGLP1RMGAT2
SCHEMBL4086686 0.85 GCGR (0.57) GCGRGIPRGLP1RGCGMGAT2

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-2003051357-A1 GLUCAGON RECEPTOR ANTAGONISTS/INVERSE AGONISTS NOVO NORDISK A/S (DK) 2003-06-26 WO disclosed