SCHEMBL2666451

SCHEMBL2666451

Cc1cc(OCc2ccc(C(=O)NCCC(=O)O)s2)cc(C)c1-c1ccc(C(F)(F)F)cc1

nearest known ligand 0.48

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.48
PPARD Q03181 14/20 0.46
PPARA Q07869 6/20 0.46
PPARG P37231 4/20 0.46
MCL1 Q07820 1/20 0.46
FFAR1 O14842 1/20 0.43

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
SCHEMBL2666428 0.92 GCGR (0.40) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2653964 0.92 GCGR (0.53) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2652922 0.90 GCGR (0.46) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2652620 0.89 GCGR (0.46) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2666496 0.89 GCGR (0.48) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2654243 0.89 GCGR (0.47) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2652586 0.89 GCGR (0.45) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2653132 0.88 GCGR (0.46) GCGRPPARDPPARAPPARGMCL1
SCHEMBL2666511 0.87 PPARD (0.47) GCGRPPARDPPARAPPARGFFAR1
SCHEMBL2654450 0.87 GCGR (0.47) GCGRPPARDPPARAPPARGMCL1

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-1856090-B1 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES LILLY CO ELI (US) 2009-10-14 EP disclosed
WO-2006086488-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-08-17 WO disclosed