SCHEMBL14014134

SCHEMBL14014134

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

nearest known ligand 0.65

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.52
ALDH1A1 P00352 5/20 0.52
SMN1; SMN2 Q16637 3/20 0.52
NPC1 O15118 1/20 0.52
RAB9A P51151 1/20 0.52
CHRNA7 P36544 1/20 0.52
HPGD P15428 4/20 0.50
GABRA2 P47869 4/20 0.50
GABRB2 P47870 4/20 0.50
POLB P06746 3/20 0.50
MAPT P10636 2/20 0.50
HSD17B10 Q99714 1/20 0.50
AHR P35869 1/20 0.50
NPSR1 Q6W5P4 1/20 0.50
TP53 P04637 3/20 0.49
RXFP1 Q9HBX9 1/20 0.49
ALPL P05186 1/20 0.49

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
SCHEMBL14014086 0.96 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2HPGDGABRA2
SCHEMBL14014042 0.96 ALDH1A1 (0.60) KDM4EALDH1A1SMN1; SMN2HPGDGABRA2
SCHEMBL14014052 0.95 ALDH1A1 (0.53) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14013931 0.95 ALDH1A1 (0.59) KDM4EALDH1A1SMN1; SMN2HPGDGABRA2
SCHEMBL14014185 0.94 KDM4E (0.55) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL4759902 0.91 SMN1; SMN2 (0.52) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14013927 0.88 KDM4E (0.49) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14014045 0.88 ALDH1A1 (0.58) KDM4EALDH1A1SMN1; SMN2NPC1RAB9A
SCHEMBL14014138 0.88 KDM4E (0.68) KDM4EALDH1A1SMN1; SMN2HPGDMAPT
SCHEMBL14014184 0.88 MAPT (0.51) KDM4EALDH1A1HPGDPOLBMAPT

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