SCHEMBL2647008

SCHEMBL2647008

O=C(C=C(C(=O)c1ccc(C(=O)NCC(O)C(=O)O)cc1)c1ccc(-c2ccccc2)cc1)c1ccc(OC(F)(F)F)cc1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 7/20 0.51
GIPR P48546 2/20 0.47
TRPV1 Q8NER1 7/20 0.43
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
IGF2BP2 Q9Y6M1 1/20 0.42
EPHX2 P34913 1/20 0.41
PPARG P37231 1/20 0.41
PPARA Q07869 1/20 0.41
MAPK14 Q16539 1/20 0.40
SCN9A Q15858 1/20 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
SCHEMBL2647002 1.00 GCGR (0.51) GCGRGIPRTRPV1CHRM2CHRM1
SCHEMBL2665119 1.00 GCGR (0.51) GCGRGIPRTRPV1CHRM2CHRM1
SCHEMBL2665131 0.91 GCGR (0.46) GCGRGIPRTRPV1CHRM2CHRM1
SCHEMBL6917347 0.89 GCGR (0.58) GCGRGIPRTRPV1EPHX2PPARG
SCHEMBL6917344 0.89 GCGR (0.58) GCGRGIPRTRPV1EPHX2PPARG
SCHEMBL2665219 0.89 GCGR (0.58) GCGRGIPRTRPV1EPHX2PPARG
SCHEMBL9071437 0.86 GCGR (0.58) GCGRGIPRTRPV1EPHX2PPARG
SCHEMBL9071390 0.85 GCGR (0.42) GCGRGIPREPHX2
SCHEMBL2648042 0.85 GCGR (0.53) GCGRGIPRTRPV1CHRM2CHRM1
SCHEMBL2648150 0.85 GCGR (0.53) GCGRGIPRTRPV1CHRM2CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1463715-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2004-10-06 EP disclosed
WO-2003048109-A1 NOVEL GLUCAGON ANTAGONISTS NOVO NORDISK A/S (DK) 2003-06-12 WO disclosed