SCHEMBL14014196

SCHEMBL14014196

O=C(O)c1cc2nc(-c3ccc(F)cc3)cc(-c3ccccc3)n2n1

nearest known ligand 0.85

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.85
ALDH1A1 P00352 10/20 0.85
HSD17B10 Q99714 4/20 0.64
MAPT P10636 5/20 0.61
MAPK1 P28482 3/20 0.61
MEN1 O00255 2/20 0.61
KMT2A Q03164 2/20 0.61
HPGD P15428 8/20 0.58
HTT P42858 4/20 0.57
TP53 P04637 3/20 0.57
LMNA P02545 4/20 0.56
NPSR1 Q6W5P4 4/20 0.56
GAA P10253 2/20 0.56
TDP1 Q9NUW8 1/20 0.56
SMN1; SMN2 Q16637 1/20 0.56
USP2 O75604 2/20 0.53
TSHR P16473 2/20 0.53
CASP1 P29466 2/20 0.53
L3MBTL1 Q9Y468 1/20 0.53
CASP7 P55210 1/20 0.53

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
SCHEMBL14014215 0.99 KDM4E (0.82) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014100 0.96 KDM4E (0.77) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014259 0.92 KDM4E (0.94) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL4491712 0.92 KDM4E (1.00) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014197 0.91 KDM4E (0.70) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014233 0.91 KDM4E (0.70) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014187 0.90 KDM4E (0.68) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014104 0.90 KDM4E (0.68) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014247 0.89 KDM4E (0.78) KDM4EALDH1A1HSD17B10MAPTMAPK1
SCHEMBL14014198 0.88 KDM4E (0.66) KDM4EALDH1A1HSD17B10MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
US-7449488-B2 Pyrazolopyrimidines as protein kinase inhibitors SCHERING CORPORATION (US) 2008-11-11 US disclosed
WO-2007044410-A1 PYRAZOLO [1,5-A] PYRIMIDINES AS PROTEIN KINASE INHIBITORS SCHERING CORPORATION (US) 2007-04-19 WO disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed
US-7196111-B2 Pyrazolo[1,5a]pyrimidine compounds as antiviral agents SCHERING CORPORATION (US) 2007-03-27 US disclosed