SCHEMBL2647574

SCHEMBL2647574

CCc1nc(C2CCCC2)c(C(=O)O)c(-c2ccc(F)cc2)c1CO

nearest known ligand 0.47

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PRKAA2 P54646 1/20 0.47
GCGR P47871 11/20 0.40
DHODH Q02127 2/20 0.39
FABP4 P15090 1/20 0.36
FABP5 Q01469 1/20 0.36
DPP4 P27487 1/20 0.36
DPP8 Q6V1X1 1/20 0.36
DPP9 Q86TI2 1/20 0.36
CETP P11597 1/20 0.35
PTGDR Q13258 1/20 0.34
PTGDR2 Q9Y5Y4 1/20 0.34
RXRA P19793 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
SCHEMBL27525559 0.92 PRKAA2 (0.51) PRKAA2GCGRDHODHFABP4FABP5
SCHEMBL2646810 0.83 PRKAA2 (0.47) PRKAA2GCGR
SCHEMBL9870568 0.82 DPP4 (0.50) PRKAA2GCGRDHODHFABP4FABP5
SCHEMBL2662929 0.79 PRKAA2 (0.44) PRKAA2GCGRCETPRXRA
SCHEMBL2662912 0.76 PRKAA2 (0.45) PRKAA2GCGRCETP
SCHEMBL9072602 0.74 PRKAA2 (0.42) PRKAA2GCGRDHODH
SCHEMBL27295913 0.74 DHODH (0.46) PRKAA2GCGRDHODHFABP4FABP5
SCHEMBL27525560 0.74 GCGR (0.43) PRKAA2GCGRPTGDRPTGDR2
SCHEMBL27525530 0.73 AR (0.42) CETPPTGDR2
SCHEMBL2647009 0.73 GAA (0.42) 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 3 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 disclosed
EP-0934274-A1 SUBSTITUTED PYRIDINES AND BIPHENYLS AS ANTI-HYPERCHOLESTERINEMIC, ANTI-HYPERLIPOPROTEINEMIC AND ANTI-HYPERGLYCEMIC AGENTS Bayer Corporation (US) 1999-08-11 EP disclosed
WO-1998004528-A2 SUBSTITUTED PYRIDINES AND BIPHENYLS AS ANTI-HYPERCHOLESTERINEMIC, ANTI-HYPERLIPOPROTEINEMIC AND ANTI-HYPERGLYCEMIC AGENTS BAYER CORPORATION (US) 1998-02-05 WO disclosed