SCHEMBL14014880

SCHEMBL14014880

O=C(O)c1cnn2c(C3CCCCC3)c(-c3ccccc3)cnc12

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 4/20 0.46
NFE2L2 Q16236 4/20 0.46
CAMKK2 Q96RR4 9/20 0.45
CAMKK1 Q8N5S9 8/20 0.45
BRS3 P32247 1/20 0.41
MAP2K1 Q02750 1/20 0.41
CLK4 Q9HAZ1 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
AXL P30530 1/20 0.41
FLT3 P36888 1/20 0.41
TYRO3 Q06418 1/20 0.41
MERTK Q12866 1/20 0.41
SGK1 O00141 1/20 0.41
AURKA O14965 1/20 0.41
SGK3 Q96BR1 1/20 0.41
SGK2 Q9HBY8 1/20 0.41
MEN1 O00255 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
KMT2A Q03164 1/20 0.40

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
SCHEMBL14014888 0.98 CAMKK2 (0.47) KEAP1NFE2L2CAMKK2CAMKK1BRS3
SCHEMBL14014957 0.91 AXL (0.41) KEAP1NFE2L2CAMKK2CAMKK1AXL
SCHEMBL4708838 0.90 BRS3 (0.46) KEAP1NFE2L2CAMKK2CAMKK1BRS3
SCHEMBL4710750 0.90 KDM4E (0.52) KEAP1NFE2L2CAMKK2CAMKK1BRS3
SCHEMBL6211737 0.90 CAMKK2 (0.40) KEAP1NFE2L2CAMKK2CAMKK1BRS3
SCHEMBL14014496 0.88 KDM4E (0.56) KEAP1NFE2L2CAMKK2CAMKK1AXL
SCHEMBL14014911 0.88 CAMKK1 (0.44) KEAP1NFE2L2CAMKK2CAMKK1SGK1
SCHEMBL14014510 0.88 MCL1 (0.43) BRS3KMT2AKDM4E
SCHEMBL14014967 0.87 KEAP1 (0.39) KEAP1NFE2L2CAMKK2CAMKK1NPC1
SCHEMBL14014928 0.87 GABBR2 (0.42) CAMKK2CAMKK1NPC1RAB9AKDR

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