SCHEMBL8484309

SCHEMBL8484309

O=C(O)c1ccccc1-c1nc(-c2ccc(F)cc2)c(-c2ccncc2)[nH]1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.73
POLB P06746 1/20 0.73
ALOX5 P09917 9/20 0.71
MAPK14 Q16539 14/20 0.70
CSNK1D P48730 5/20 0.70
CSNK1E P49674 4/20 0.70
MAPK13 O15264 11/20 0.67
MAPK12 P53778 11/20 0.67
MAPK11 Q15759 11/20 0.67
GCGR P47871 10/20 0.67
TGFBR1 P36897 1/20 0.67
PRKD3 O94806 2/20 0.62
MAP4K4 O95819 2/20 0.62
FRK P42685 2/20 0.62
MAPK9 P45984 2/20 0.62
CSNK1A1 P48729 2/20 0.62
GSK3B P49841 2/20 0.62
PTK6 Q13882 2/20 0.62
CLK4 Q9HAZ1 2/20 0.62
PRKD2 Q9BZL6 1/20 0.62

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
SCHEMBL8484842 0.90 ALOX5 (0.69) KDM4EPOLBALOX5MAPK14CSNK1D
SCHEMBL8483911 0.88 ALOX5 (0.69) KDM4EPOLBALOX5MAPK14CSNK1D
SCHEMBL8486398 0.83 ALOX5 (0.69) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL4563107 0.83 ALOX5 (1.00) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL17002317 0.83 MAPK14 (1.00) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL30197605 0.83 MAPK14 (1.00) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL4552316 0.81 MAPK14 (1.00) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL9195042 0.81 MAPK14 (1.00) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL413667 0.81 MAPK14 (1.00) KDM4EALOX5MAPK14CSNK1DCSNK1E
SCHEMBL17002225 0.81 MAPK14 (0.77) KDM4EALOX5MAPK14CSNK1DCSNK1E

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-5916891-A CYTOKINE MEDIATED DISEASES SMITHKLINE BEECHAM CORPORATION (US) 1999-06-29 US disclosed
US-5686455-A Imidazole derivatives and their use as cytokine inhibitors SMITHKLINE BEECHAM CORPORATION (US) 1997-11-11 US disclosed