SCHEMBL14014902

SCHEMBL14014902

CS(=O)(=O)c1cccc(-c2ccc(-c3cnc4c(C(=O)O)cnn4c3C3CCCCC3)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 5/20 0.43
NFE2L2 Q16236 5/20 0.43
CPT2 P23786 1/20 0.42
CPT1A P50416 1/20 0.42
CAMKK2 Q96RR4 4/20 0.42
CAMKK1 Q8N5S9 3/20 0.42
NTRK1 P04629 1/20 0.41
MET P08581 1/20 0.41
PIM1 P11309 1/20 0.41
FGFR1 P11362 1/20 0.41
MAP2K2 P36507 1/20 0.41
FLT3 P36888 1/20 0.41
MAPK8 P45983 1/20 0.41
GSK3B P49841 1/20 0.41
NTRK3 Q16288 1/20 0.41
ALK Q9UM73 1/20 0.41
DYRK1B Q9Y463 1/20 0.41
CNR1 P21554 1/20 0.41
SYK P43405 1/20 0.40
KCNH2 Q12809 2/20 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
SCHEMBL4708703 0.90 PTGS2 (0.45) KEAP1NFE2L2CAMKK2CAMKK1KDR
SCHEMBL14014888 0.86 CAMKK2 (0.47) KEAP1NFE2L2CAMKK2CAMKK1FLT3
SCHEMBL4708491 0.85 HSD17B10 (0.47) KEAP1NFE2L2CAMKK2CAMKK1PIM1
SCHEMBL14014911 0.85 CAMKK1 (0.44) KEAP1NFE2L2CAMKK2CAMKK1KDR
SCHEMBL14014880 0.84 KEAP1 (0.46) KEAP1NFE2L2CAMKK2CAMKK1FLT3
SCHEMBL14014913 0.83 KDM4E (0.46) KEAP1NFE2L2CAMKK2CAMKK1NTRK1
SCHEMBL14014894 0.82 ACVR1 (0.40) CAMKK2NTRK1METPIM1FGFR1
SCHEMBL14014496 0.80 KDM4E (0.56) KEAP1NFE2L2CAMKK2CAMKK1FLT3
SCHEMBL4710750 0.79 KDM4E (0.52) KEAP1NFE2L2CAMKK2CAMKK1FLT3
SCHEMBL6211737 0.79 CAMKK2 (0.40) KEAP1NFE2L2CAMKK2CAMKK1CNR1

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