SCHEMBL4776889

SCHEMBL4776889

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

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CCNC P24863 5/20 0.42
CDK8 P49336 5/20 0.42
KDR P35968 3/20 0.38
HDAC6 Q9UBN7 3/20 0.38
PLK4 O00444 2/20 0.38
AURKA O14965 2/20 0.38
MAP4K4 O95819 2/20 0.38
PAK4 O96013 2/20 0.38
ABL1 P00519 2/20 0.38
LCK P06239 2/20 0.38
CSF1R P07333 2/20 0.38
RET P07949 2/20 0.38
MET P08581 2/20 0.38
PDGFRB P09619 2/20 0.38
KIT P10721 2/20 0.38
FGFR1 P11362 2/20 0.38
PDGFRA P16234 2/20 0.38
FLT1 P17948 2/20 0.38
FGFR3 P22607 2/20 0.38
TYK2 P29597 2/20 0.38

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
SCHEMBL4776882 1.00 CCNC (0.42) CCNCCDK8KDRHDAC6PLK4
SCHEMBL10126734 0.84 KMT2A (0.40) KDRHDAC6AURKALCKMET
SCHEMBL4668018 0.83 CAMKK2 (0.38) CCNCCDK8KDRAURKAFGFR1
SCHEMBL4667699 0.83 CAMKK2 (0.38) CCNCCDK8KDRAURKAFGFR1
SCHEMBL4669118 0.81 MMP1 (0.53) GSK3BMAPTMEN1ALDH1A1KMT2A
SCHEMBL4669121 0.81 MMP1 (0.53) GSK3BMAPTMEN1ALDH1A1KMT2A
SCHEMBL4666025 0.80 HPGD (0.49) HDAC6GSK3BMEN1ALDH1A1HPGD
SCHEMBL4666020 0.80 HPGD (0.49) HDAC6GSK3BMEN1ALDH1A1HPGD
SCHEMBL10126737 0.79 CA12 (0.42) CCNCCDK8AURKAGSK3AGSK3B
SCHEMBL4667782 0.78 SMN1; SMN2 (0.52) HDAC6GSK3BMEN1HPGDKMT2A

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
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