SCHEMBL1850574

SCHEMBL1850574

COc1ccc2oc3c(=O)[nH]c([C@@H]4CCCN4C(=O)OC(C)(C)C)nc3c2c1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 12/20 0.59
CSNK2B P67870 12/20 0.59
CDC7 O00311 11/20 0.59
CSNK2A1 P68400 10/20 0.59
CSNK2A2 P19784 3/20 0.45
PIM3 Q86V86 2/20 0.45
PIM2 Q9P1W9 2/20 0.45
HRH4 Q9H3N8 1/20 0.43
CIT O14578 1/20 0.42
CYP1A2 P05177 1/20 0.42
GSK3B P49841 1/20 0.42
DYRK1A Q13627 1/20 0.42
CSNK2A3 Q8NEV1 1/20 0.42
TAOK3 Q9H2K8 1/20 0.42
KDM4E B2RXH2 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
HCRTR1 O43613 3/20 0.40
HCRTR2 O43614 3/20 0.40

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
SCHEMBL1851020 1.00 PIM1 (0.59) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL4114444 0.90 PIM1 (0.62) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL4113615 0.90 PIM1 (0.62) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1855901 0.89 PIM1 (0.70) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1849975 0.89 PIM1 (0.70) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1852448 0.86 PIM1 (0.59) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1850649 0.86 PIM1 (0.59) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1850651 0.86 PIM1 (0.59) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1848761 0.85 PIM1 (0.52) PIM1CSNK2BCDC7CSNK2A1CSNK2A2
SCHEMBL1848762 0.85 PIM1 (0.52) PIM1CSNK2BCDC7CSNK2A1CSNK2A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097419-B1 BENZOFUROPYRIMIDINONES AS PROTEIN KINASE INHIBITORS EXELIXIS INC (US) 2011-05-25 EP disclosed