SCHEMBL2653440

SCHEMBL2653440

Cc1cc(SCC(C)Cc2ccc(C(=O)NCCC(=O)O)s2)cc(C)c1-c1ccc(C(C)C)cc1

nearest known ligand 0.39

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GCGR P47871 15/20 0.39
GCG P01275 2/20 0.39
KMT2A Q03164 1/20 0.35
GIPR P48546 1/20 0.34
MCL1 Q07820 1/20 0.34

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
SCHEMBL2653891 0.84 GCGR (0.42) GCGRGCGKMT2AGIPRMCL1
SCHEMBL2654671 0.81 GCGR (0.39) GCGRKMT2AMCL1
SCHEMBL2654683 0.81 GCGR (0.46) GCGRGCGKMT2AGIPRMCL1
SCHEMBL2656044 0.81 GCGR (0.42) GCGRGIPRMCL1
SCHEMBL2661440 0.81 PPARD (0.37) GCGRGIPRMCL1
SCHEMBL2653438 0.79 GCG (0.41) GCGRGCGKMT2AGIPRMCL1
SCHEMBL2653436 0.79 GCG (0.41) GCGRGCGKMT2AGIPRMCL1
SCHEMBL2653953 0.78 GCGR (0.43) GCGRGCGKMT2AGIPRMCL1
SCHEMBL2653332 0.77 GCGR (0.46) GCGRGCGKMT2AGIPRMCL1
SCHEMBL2653101 0.77 GCGR (0.42) GCGRGCGKMT2AGIPRMCL1

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