SCHEMBL6184414

SCHEMBL6184414

O=C(O)Oc1cc(-c2c(-c3ccc(F)cc3)nn3c(Cl)cccc23)nc(NC2CCCC2)n1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 4/20 0.43
PTGS2 P35354 3/20 0.37
PTGS1 P23219 2/20 0.37
KDM4E B2RXH2 2/20 0.36
ADORA1 P30542 1/20 0.33
CSNK1D P48730 1/20 0.33
DGAT2 Q96PD7 1/20 0.33
CSNK1E P49674 1/20 0.33
SCN9A Q15858 1/20 0.33
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
MAPT P10636 1/20 0.33
CYP2C9 P11712 1/20 0.33
HPGD P15428 1/20 0.33
CYP2C19 P33261 1/20 0.33

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
SCHEMBL5448946 0.88 MAPK14 (0.46) MAPK14PTGS2PTGS1KDM4EADORA1
SCHEMBL5459562 0.86 MAPK14 (0.44) MAPK14PTGS2PTGS1KDM4ECSNK1D
SCHEMBL5455132 0.86 MAPK14 (0.48) MAPK14PTGS2PTGS1KDM4EADORA1
SCHEMBL5457461 0.85 MAPK14 (0.44) MAPK14KDM4EDGAT2MAPT
SCHEMBL5455164 0.84 MAPK14 (0.48) MAPK14PTGS2PTGS1KDM4ECSNK1D
SCHEMBL5457274 0.83 MAPK14 (0.46) MAPK14KDM4EADORA1CSNK1DMAPT
SCHEMBL5460496 0.82 MAPK14 (0.46) MAPK14KDM4EADORA1CSNK1DMAPT
SCHEMBL5461798 0.80 MAPK14 (0.53) MAPK14CSNK1D
SCHEMBL5462366 0.80 MAPK14 (0.43) MAPK14KDM4ECSNK1DMAPT
SCHEMBL5455260 0.80 MAPK14 (0.44) MAPK14PTGS2PTGS1CSNK1D

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-1377573-B1 PYRAZOLOPYRIDINE DERIVATIVES GLAXO GROUP LTD (GB) 2005-07-27 EP claimed