SCHEMBL2665144

SCHEMBL2665144

O=C(CC(C(=O)c1ccc(C(=O)NC[C@@H](O)C(=O)O)cc1)c1ccc(C2CCCCC2)cc1)c1cc(C(F)(F)F)cc(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 12/20 0.51
GIPR P48546 12/20 0.51
GLP1R P43220 2/20 0.44
PPARD Q03181 1/20 0.42
TACR1 P25103 1/20 0.41
KDM1A O60341 1/20 0.41
SERPINE1 P05121 1/20 0.38
APAF1 O14727 1/20 0.37
BCL2L1 Q07817 2/20 0.37
MCL1 Q07820 2/20 0.37
HAO1 Q9UJM8 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
SCHEMBL6916484 0.88 GCGR (0.53) GCGRGIPRGLP1RAPAF1BCL2L1
SCHEMBL6916489 0.88 GCGR (0.53) GCGRGIPRGLP1RAPAF1BCL2L1
SCHEMBL2651641 0.87 PPARD (0.47) GCGRGIPRGLP1RPPARDKDM1A
SCHEMBL2652188 0.87 PPARD (0.47) GCGRGIPRGLP1RPPARDKDM1A
SCHEMBL2647399 0.87 PPARD (0.47) GCGRGIPRGLP1RPPARDKDM1A
SCHEMBL2648952 0.86 GCGR (0.48) GCGRGIPRPPARDSERPINE1APAF1
SCHEMBL2648950 0.86 GCGR (0.48) GCGRGIPRPPARDSERPINE1APAF1
SCHEMBL2645893 0.85 GCGR (0.46) GCGRGIPRSERPINE1APAF1BCL2L1
SCHEMBL2645898 0.85 GCGR (0.46) GCGRGIPRSERPINE1APAF1BCL2L1
SCHEMBL2665061 0.85 GCGR (0.55) GCGRGIPRGLP1RPPARDSERPINE1

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