SCHEMBL14014185

SCHEMBL14014185

CCOC(=O)c1cc2nc(-c3ccc(Cl)cc3)cc(-c3ccc(OC)cc3)n2n1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.55
ALDH1A1 P00352 4/20 0.55
HPGD P15428 4/20 0.55
HSD17B10 Q99714 2/20 0.55
CASP1 P29466 1/20 0.55
CASP7 P55210 1/20 0.55
TP53 P04637 3/20 0.54
GABRA2 P47869 1/20 0.52
GABRB2 P47870 1/20 0.52
MAPT P10636 6/20 0.52
LMNA P02545 2/20 0.52
MEN1 O00255 1/20 0.51
KMT2A Q03164 1/20 0.51
ATM Q13315 1/20 0.51
POLB P06746 3/20 0.50
AHR P35869 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
CHRNA7 P36544 1/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 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
SCHEMBL14014134 0.94 KDM4E (0.52) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14014184 0.90 MAPT (0.51) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL14014042 0.90 ALDH1A1 (0.60) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14014086 0.90 ALDH1A1 (0.60) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14014052 0.89 ALDH1A1 (0.53) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14013931 0.89 ALDH1A1 (0.59) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14014192 0.86 KDM4E (0.64) KDM4EALDH1A1HPGDHSD17B10CASP1
SCHEMBL4759902 0.85 SMN1; SMN2 (0.52) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14013927 0.83 KDM4E (0.49) KDM4EALDH1A1HPGDHSD17B10TP53
SCHEMBL14014045 0.83 ALDH1A1 (0.58) KDM4EALDH1A1HPGDHSD17B10CASP1

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 4 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
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