SCHEMBL14014104

SCHEMBL14014104

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

nearest known ligand 0.68

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 7/20 0.68
ALDH1A1 P00352 6/20 0.68
MEN1 O00255 2/20 0.59
KMT2A Q03164 2/20 0.59
ATM Q13315 1/20 0.59
HPGD P15428 5/20 0.54
TTR P02766 1/20 0.53
HSD17B10 Q99714 3/20 0.52
MARS1 P56192 1/20 0.52
MAPT P10636 2/20 0.50
MAPK1 P28482 1/20 0.50
TP53 P04637 2/20 0.49
SMN1; SMN2 Q16637 3/20 0.49
RPA1 P27694 1/20 0.49
GAA P10253 1/20 0.48
DHODH Q02127 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
HTT P42858 1/20 0.47

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
SCHEMBL14014187 1.00 KDM4E (0.68) KDM4EALDH1A1MEN1KMT2AATM
SCHEMBL14014189 0.94 KDM4E (0.77) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL14014100 0.94 KDM4E (0.77) KDM4EALDH1A1MEN1KMT2AATM
SCHEMBL14014228 0.92 KDM4E (0.63) KDM4EALDH1A1MEN1KMT2AATM
SCHEMBL14014196 0.90 KDM4E (0.85) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL14014105 0.90 KDM4E (0.85) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL14014099 0.90 KDM4E (0.85) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL14014194 0.89 KDM4E (0.82) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL14014215 0.89 KDM4E (0.82) KDM4EALDH1A1MEN1KMT2AHPGD
SCHEMBL14014186 0.89 KDM4E (0.66) KDM4EALDH1A1MEN1KMT2AATM

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