SCHEMBL14014351

SCHEMBL14014351

O=C(O)c1cc2nc(-c3ccc(OCc4ccccc4)cc3)cc(-c3cccc(F)c3)n2n1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.59
ALDH1A1 P00352 4/20 0.59
MCL1 Q07820 5/20 0.54
MDM2 Q00987 2/20 0.52
HSD17B10 Q99714 2/20 0.49
HPGD P15428 2/20 0.46
GAA P10253 1/20 0.46
SMN1; SMN2 Q16637 1/20 0.46
MMP1 P03956 1/20 0.46
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
MMP13 P45452 1/20 0.46
NR4A2 P43354 1/20 0.46
GPR34 Q9UPC5 1/20 0.46
BCL2 P10415 1/20 0.46
MAPT P10636 3/20 0.45
MEN1 O00255 1/20 0.45
MAPK1 P28482 1/20 0.45
KMT2A Q03164 1/20 0.45
FFAR1 O14842 1/20 0.45

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
SCHEMBL14014235 0.91 KDM4E (0.63) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014349 0.91 KDM4E (0.72) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014326 0.90 KDM4E (0.70) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014338 0.89 KDM4E (0.59) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014299 0.88 KDM4E (0.60) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014217 0.87 KDM4E (0.65) KDM4EALDH1A1MCL1HSD17B10HPGD
SCHEMBL14014247 0.87 KDM4E (0.78) KDM4EALDH1A1HSD17B10HPGDGAA
SCHEMBL14014298 0.86 MCL1 (0.66) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014339 0.85 ALDH1A1 (0.63) KDM4EALDH1A1MCL1MDM2HSD17B10
SCHEMBL14014350 0.85 KDM4E (0.63) KDM4EALDH1A1MCL1MDM2HSD17B10

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