SCHEMBL4495281

SCHEMBL4495281

Cc1cccc(-c2ccc3c(NC(=O)COc4ccc(Cl)cc4)n[nH]c3c2)c1

nearest known ligand 0.55

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 8/20 0.55
HDAC1 Q13547 8/20 0.55
HDAC2 Q92769 8/20 0.55
HDAC8 Q9BY41 8/20 0.55
MEN1 O00255 1/20 0.52
POLB P06746 1/20 0.52
KMT2A Q03164 1/20 0.52
FGFR1 P11362 1/20 0.52
FGFR2 P21802 1/20 0.52
FGFR3 P22607 1/20 0.52
HDAC6 Q9UBN7 2/20 0.50

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
SCHEMBL4490092 0.92 GSK3B (0.60) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4486772 0.91 HDAC1 (0.66) GSK3BHDAC1HDAC2HDAC8FGFR1
SCHEMBL4499827 0.91 GSK3B (0.64) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4491185 0.90 GSK3B (0.64) GSK3BHDAC1HDAC2HDAC8FGFR1
SCHEMBL4479929 0.89 HDAC1 (0.67) GSK3BHDAC1HDAC2HDAC8FGFR1
SCHEMBL4487643 0.89 FGFR2 (0.55) GSK3BHDAC1HDAC2HDAC8FGFR1
SCHEMBL4490651 0.89 HDAC1 (0.68) GSK3BHDAC1HDAC2HDAC8FGFR1
SCHEMBL4484179 0.88 GSK3B (0.59) GSK3BHDAC1HDAC2HDAC8FGFR1
SCHEMBL4494795 0.88 GSK3B (0.55) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4488966 0.88 GSK3B (0.57) GSK3BHDAC1HDAC2HDAC8HDAC6

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