SCHEMBL4490359

SCHEMBL4490359

Cc1cccc(-c2ccc3c(NC(=O)NCCc4ccccn4)n[nH]c3c2)c1

nearest known ligand 0.55

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
MAPK1 P28482 3/20 0.55
GSK3B P49841 6/20 0.49
FGFR1 P11362 1/20 0.47
FGFR2 P21802 1/20 0.47
FGFR3 P22607 1/20 0.47
CYP1A2 P05177 1/20 0.46
GSK3A P49840 1/20 0.45
HDAC6 Q9UBN7 3/20 0.45
TAS1R3 Q7RTX0 1/20 0.45
TAS1R1 Q7RTX1 1/20 0.45
CNR1 P21554 1/20 0.44
HDAC1 Q13547 1/20 0.44
HDAC2 Q92769 1/20 0.44
HDAC8 Q9BY41 1/20 0.44
FGFR4 P22455 1/20 0.44
AAK1 Q2M2I8 1/20 0.43

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
SCHEMBL12886200 0.94 MAPK1 (0.56) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4492154 0.93 MAPK1 (0.56) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4480524 0.88 AAK1 (0.58) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4494147 0.88 HDAC1 (0.57) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4494405 0.87 GSK3B (0.55) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL12886132 0.86 MAPK1 (0.49) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4485793 0.86 MAPK1 (0.54) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4504003 0.84 GSK3B (0.57) MAPK1GSK3BFGFR1FGFR2FGFR3
SCHEMBL4480187 0.84 GSK3B (0.59) GSK3BFGFR1FGFR2FGFR3CYP1A2
SCHEMBL4494624 0.83 GSK3B (0.53) GSK3BFGFR1FGFR2FGFR3CYP1A2

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7632854-B2 Aminoindazole derivatives active as kinase inhibitors, process for their preparation and pharmaceutical compositions comprising them PFIZER ITALIA S.R.L. (IT) 2009-12-15 US claimed