SCHEMBL2652866

SCHEMBL2652866

CC(CCc1ccc(C(=O)NCCC(=O)O)s1)COc1ccc(-c2ccc(C(F)(F)F)cc2)cc1

nearest known ligand 0.43

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.43
PPARD Q03181 3/20 0.40
PPARG P37231 2/20 0.40
PPARA Q07869 2/20 0.40
GIPR P48546 4/20 0.39
VIPR2 P41587 1/20 0.38
GLP1R P43220 1/20 0.38
KMT2A Q03164 1/20 0.38

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
SCHEMBL2653339 0.95 GCGR (0.42) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2654877 0.92 HPGD (0.36) GCGRPPARDPPARGPPARAKMT2A
SCHEMBL2655260 0.91 GCGR (0.45) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2654440 0.90 GCGR (0.47) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2653887 0.86 PPARA (0.42) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2653246 0.85 FFAR4 (0.43) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2652510 0.84 FFAR4 (0.42) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2666511 0.84 PPARD (0.47) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2653599 0.83 FFAR4 (0.41) GCGRPPARDPPARGPPARAGIPR
SCHEMBL2655570 0.83 FFAR4 (0.41) GCGRPPARDPPARGPPARAGIPR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1856090-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-11-21 EP claimed
WO-2006086488-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2006-08-17 WO claimed
EP-1856090-A2 SUBSTITUTED THIOPHENE DERIVATIVES AS GLUCAGON RECEPTOR ANTAGONISTS, PREPARATION AND THERAPEUTIC USES ELI LILLY AND COMPANY (US) 2007-11-21 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