SCHEMBL4495755

SCHEMBL4495755

Cc1cccc(-c2ccc3c(NC(=O)c4ccco4)n[nH]c3c2)c1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 6/20 0.55
NPC1 O15118 2/20 0.53
RAB9A P51151 2/20 0.53
GSK3A P49840 2/20 0.53
CDK2 P24941 1/20 0.53
FGFR4 P22455 1/20 0.51
GSK3B P49841 4/20 0.50
FGFR1 P11362 2/20 0.50
FGFR2 P21802 2/20 0.50
FGFR3 P22607 2/20 0.50
MAPK1 P28482 1/20 0.49
AAK1 Q2M2I8 3/20 0.48
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
USP2 O75604 1/20 0.48
ALDH1A1 P00352 1/20 0.48
TP53 P04637 1/20 0.48
MAPT P10636 1/20 0.48
ALOX15 P16050 1/20 0.48
KMT2A Q03164 1/20 0.48

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
SCHEMBL4497998 0.93 HDAC6 (0.65) HDAC6GSK3ACDK2FGFR4GSK3B
SCHEMBL4494227 0.89 HDAC6 (0.65) HDAC6GSK3ACDK2GSK3BFGFR1
SCHEMBL4480839 0.88 MAPT (0.60) HDAC6NPC1RAB9AGSK3ACDK2
SCHEMBL4502571 0.88 MAPK1 (0.55) HDAC6GSK3ACDK2FGFR4GSK3B
SCHEMBL4483351 0.87 HDAC6 (0.53) HDAC6NPC1RAB9AGSK3ACDK2
SCHEMBL4495224 0.87 HDAC6 (0.67) HDAC6GSK3ACDK2GSK3BFGFR1
SCHEMBL4494927 0.87 HDAC6 (0.69) HDAC6NPC1RAB9AGSK3ACDK2
SCHEMBL4480767 0.87 MAPT (0.48) HDAC6NPC1RAB9AGSK3ACDK2
SCHEMBL4494101 0.85 HDAC6 (0.57) HDAC6GSK3ACDK2GSK3BFGFR1
SCHEMBL4490916 0.85 GSK3B (0.59) HDAC6NPC1RAB9AGSK3ACDK2

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