SCHEMBL4667699

SCHEMBL4667699

NC(=O)C=Cc1n[nH]c2ncccc12

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CAMKK2 Q96RR4 2/20 0.38
CCNC P24863 2/20 0.37
CDK8 P49336 2/20 0.37
KMT2A Q03164 1/20 0.36
MAP2K1 Q02750 1/20 0.35
KDR P35968 2/20 0.35
GSK3A P49840 1/20 0.35
GSK3B P49841 1/20 0.35
KDM4E B2RXH2 2/20 0.34
PARP1 P09874 2/20 0.34
TDP1 Q9NUW8 1/20 0.34
AURKA O14965 1/20 0.34
FEN1 P39748 1/20 0.34
NEK2 P51955 1/20 0.34
PLK1 P53350 1/20 0.34
IKBKB O14920 1/20 0.33
CHUK O15111 1/20 0.33
LIMK1 P53667 1/20 0.33
RPS6KB1 P23443 1/20 0.33
APP P05067 1/20 0.33

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
SCHEMBL4668018 1.00 CAMKK2 (0.38) CAMKK2CCNCCDK8KMT2AMAP2K1
SCHEMBL10126734 0.87 KMT2A (0.40) CAMKK2KMT2AMAP2K1KDRGSK3A
SCHEMBL4776889 0.83 CCNC (0.42) CAMKK2CCNCCDK8KMT2AMAP2K1
SCHEMBL4776882 0.83 CCNC (0.42) CAMKK2CCNCCDK8KMT2AMAP2K1
SCHEMBL10126737 0.79 CA12 (0.42) CCNCCDK8GSK3AGSK3BKDM4E
SCHEMBL4669121 0.78 MMP1 (0.53) KMT2AGSK3BKDM4E
SCHEMBL4669118 0.78 MMP1 (0.53) KMT2AGSK3BKDM4E
SCHEMBL2570808 0.77 KDR (0.47) CAMKK2MAP2K1KDRKDM4EAURKA
SCHEMBL12336934 0.76 KMT2A (0.37) KMT2AMAP2K1KDRGSK3AGSK3B
SCHEMBL15304874 0.76 CAPN1 (0.49) GSK3BPARP1

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
EP-1980561-B1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 EP claimed
EP-1980561-A1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-10-15 EP claimed
EP-1980561-B1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES SRL (IT) 2013-10-09 EP disclosed
EP-1980561-A1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-10-15 EP disclosed
EP-1980561-A1 Substituted 1h-pyrazolo[3,4-b] pyridine derivatives active as kinase inhibitors NERVIANO MEDICAL SCIENCES S.r.l. (IT) 2008-10-15 EP disclosed