SCHEMBL9195650

SCHEMBL9195650

Oc1ccc(-c2nc(-c3ccc(F)cc3)[nH]c2-c2ccncc2)cc1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 15/20 1.00
MAPK12 P53778 15/20 1.00
MAPK11 Q15759 15/20 1.00
MAPK14 Q16539 15/20 1.00
GCGR P47871 13/20 1.00
ALOX5 P09917 12/20 1.00
PRKD3 O94806 3/20 1.00
MAP4K4 O95819 3/20 1.00
FRK P42685 3/20 1.00
MAPK9 P45984 3/20 1.00
CSNK1A1 P48729 3/20 1.00
CSNK1D P48730 3/20 1.00
GSK3B P49841 3/20 1.00
CLK4 Q9HAZ1 3/20 1.00
PTK6 Q13882 2/20 1.00
RAF1 P04049 2/20 1.00
BRAF P15056 2/20 1.00
PRKACA P17612 2/20 1.00
SLK Q9H2G2 2/20 1.00
KDM4E B2RXH2 1/20 1.00

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
Sb-202190 SCHEMBL158854 1.00 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
Sb-202190 SCHEMBL3386753 1.00 MAPK13 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
Sb-202190 SCHEMBL4893304 0.99 MAPK13 (0.97) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL19868925 0.93 MAPK11 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL15075603 0.93 MAPK11 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
Sb-202190 SCHEMBL6420498 0.89 MAPK13 (0.81) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL28486758 0.87 MAPK14 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL4552316 0.87 MAPK14 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL6469877 0.87 MAPK14 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR
SCHEMBL2650702 0.87 MAPK11 (1.00) MAPK13MAPK12MAPK11MAPK14GCGR

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
EP-0624159-A4 PYRIDYL SUBSTITUTED IMIDAZOLES. SMITHKLINE BEECHAM CORP (US) 1995-04-12 EP claimed
EP-0624159-A1 PYRIDYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1994-11-17 EP claimed
WO-1993014082-A1 PYRIDYL SUBSTITUTED IMIDAZOLES SMITHKLINE BEECHAM CORPORATION (US) 1993-07-22 WO claimed