SCHEMBL2647302

SCHEMBL2647302

CCOC(=O)c1c(C(C)C)nc(C(C)C)c(C(O[SiH](C)C)C(C)(C)C)c1-c1ccc(F)cc1

nearest known ligand 0.48

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
GCGR P47871 16/20 0.48
TRPM8 Q7Z2W7 1/20 0.41
SLC10A2 Q12908 1/20 0.41
ALDH1A1 P00352 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MEN1 O00255 1/20 0.39
MAPT P10636 1/20 0.39
KMT2A Q03164 1/20 0.39
GPR55 Q9Y2T6 1/20 0.39

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
SCHEMBL9152685 0.91 GCGR (0.45) GCGRTRPM8SLC10A2ALDH1A1L3MBTL1
SCHEMBL9269784 0.90 GCGR (0.41) GCGRTRPM8SLC10A2ALDH1A1L3MBTL1
SCHEMBL9743385 0.90 TRPM8 (0.38) GCGRTRPM8SLC10A2ALDH1A1L3MBTL1
SCHEMBL2648227 0.82 GCGR (0.60) GCGRSLC10A2ALDH1A1L3MBTL1
SCHEMBL2648212 0.82 GCGR (0.62) GCGRTRPM8SLC10A2ALDH1A1L3MBTL1
SCHEMBL2648610 0.82 GCGR (0.53) GCGRSLC10A2ALDH1A1L3MBTL1
SCHEMBL2648395 0.81 GCGR (0.52) GCGRSLC10A2ALDH1A1L3MBTL1MEN1
SCHEMBL2648307 0.80 GCGR (0.57) GCGR
SCHEMBL27350569 0.80 GCGR (0.45) GCGR
SCHEMBL27311063 0.78 GCGR (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 2 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
US-5183897-A Certain intermediate imino-substituted pyridines BAYER AKTIENGESELLSCHAFT (DE) 1993-02-02 US disclosed