SCHEMBL2664964

SCHEMBL2664964

CS(=O)(=O)c1cc(C(=O)/C=C(\C(=O)c2ccc(C(=O)NCCC(=O)O)cc2)c2ccc3c(c2)CCC3)ccc1OC(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCGR P47871 15/20 0.41
GIPR P48546 8/20 0.41
PPARD Q03181 1/20 0.37
TRPV1 Q8NER1 3/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37

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
SCHEMBL2665120 0.88 GCGR (0.49) GCGRGIPRPPARDTRPV1NPC1
SCHEMBL2665121 0.86 GCGR (0.51) GCGRGIPRPPARDTRPV1
SCHEMBL2665082 0.85 GCGR (0.46) GCGRGIPRPPARD
SCHEMBL2655953 0.84 GCGR (0.52) GCGRGIPRTRPV1
SCHEMBL2655948 0.84 GCGR (0.52) GCGRGIPRTRPV1
SCHEMBL9071398 0.83 GCGR (0.46) GCGRGIPRTRPV1
SCHEMBL2647981 0.83 GCGR (0.52) GCGRGIPRTRPV1
SCHEMBL2665225 0.83 GCGR (0.52) GCGRGIPRTRPV1
SCHEMBL2647975 0.83 GCGR (0.52) GCGRGIPRTRPV1
SCHEMBL9071397 0.82 GCGR (0.46) GCGRGIPRTRPV1

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