SCHEMBL14014303

SCHEMBL14014303

O=C(O)c1cc2nc(-c3ccc(C(F)(F)F)cc3)cc(-c3cc(Cl)cc(Cl)c3)n2n1

nearest known ligand 0.59

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 7/20 0.59
KDM4E B2RXH2 6/20 0.59
TTR P02766 1/20 0.57
HSD17B10 Q99714 4/20 0.57
TP53 P04637 3/20 0.51
MAPT P10636 3/20 0.49
MAPK1 P28482 2/20 0.49
CASP1 P29466 2/20 0.49
TSHR P16473 1/20 0.49
MARS1 P56192 1/20 0.48
THRB P10828 2/20 0.47
APOBEC3A P31941 1/20 0.47
HTT P42858 1/20 0.47
SMN1; SMN2 Q16637 4/20 0.46
HPGD P15428 3/20 0.46
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
CASP7 P55210 1/20 0.43
GAA P10253 1/20 0.43

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
SCHEMBL14014278 0.92 ALDH1A1 (0.64) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014276 0.90 ALDH1A1 (0.62) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014227 0.88 KDM4E (0.67) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014302 0.88 TTR (0.71) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL25337825 0.87 KDM4E (0.79) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014283 0.86 KDM4E (0.77) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014280 0.85 TTR (0.56) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14541764 0.83 KDM4E (0.61) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014288 0.83 MAPT (0.61) ALDH1A1KDM4ETTRHSD17B10TP53
SCHEMBL14014289 0.83 MAPT (0.61) ALDH1A1KDM4ETTRHSD17B10TP53

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