SCHEMBL2647583

SCHEMBL2647583

CC(C)c1cc(C(C)C)c(C(C)O)c(-c2ccccc2O)c1CSc1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GCGR P47871 10/20 0.48
DAO P14920 1/20 0.33
SLC37A4 O43826 1/20 0.32
PTPN1 P18031 1/20 0.32
CDC25A P30304 1/20 0.32
CDC25B P30305 1/20 0.32
GABRA1 P14867 1/20 0.31
GABRB2 P47870 1/20 0.31
IKBKB O14920 1/20 0.31
P4HB P07237 1/20 0.30

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
SCHEMBL2648481 0.91 GCGR (0.50) GCGRDAO
SCHEMBL2649666 0.90 GCGR (0.42) GCGRSLC37A4GABRA1GABRB2P4HB
SCHEMBL2648244 0.88 GCGR (0.41) GCGRDAOSLC37A4PTPN1CDC25A
SCHEMBL2648096 0.86 GCGR (0.47) GCGRDAO
SCHEMBL2647610 0.85 GCGR (0.60) GCGR
SCHEMBL2647585 0.85 GCGR (0.38) GCGRDAOSLC37A4PTPN1CDC25A
SCHEMBL2647443 0.84 GCGR (0.67) GCGR
SCHEMBL2647527 0.82 GCGR (0.62) GCGR
SCHEMBL2649721 0.80 GCGR (0.62) GCGR
SCHEMBL2665676 0.80 GCGR (0.62) GCGR

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
US-6218431-B1 GLUCAGON RECEPTOR ANTAGONISTS FOR THERAPY OF DIABETES AND CONDITIONS ASSOCIATED WITH DIABETES BAYER CORPORATION 2001-04-17 US claimed
EP-0934274-A1 SUBSTITUTED PYRIDINES AND BIPHENYLS AS ANTI-HYPERCHOLESTERINEMIC, ANTI-HYPERLIPOPROTEINEMIC AND ANTI-HYPERGLYCEMIC AGENTS Bayer Corporation (US) 1999-08-11 EP claimed
WO-1998004528-A2 SUBSTITUTED PYRIDINES AND BIPHENYLS AS ANTI-HYPERCHOLESTERINEMIC, ANTI-HYPERLIPOPROTEINEMIC AND ANTI-HYPERGLYCEMIC AGENTS BAYER CORPORATION (US) 1998-02-05 WO claimed
US-6218431-B1 GLUCAGON RECEPTOR ANTAGONISTS FOR THERAPY OF DIABETES AND CONDITIONS ASSOCIATED WITH DIABETES BAYER CORPORATION 2001-04-17 US disclosed