SCHEMBL4497518

SCHEMBL4497518

COCC(=O)Nc1n[nH]c2cc(-c3ccccc3)ccc12

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 12/20 0.76
HDAC1 Q13547 6/20 0.67
HDAC2 Q92769 6/20 0.67
HDAC8 Q9BY41 6/20 0.67
GSK3A P49840 2/20 0.63
HDAC6 Q9UBN7 1/20 0.61
CYP1A2 P05177 1/20 0.59
FGFR1 P11362 1/20 0.59
FGFR2 P21802 1/20 0.59
FGFR3 P22607 1/20 0.59

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
SCHEMBL4503195 0.90 GSK3B (0.73) GSK3BHDAC1HDAC2HDAC8CYP1A2
SCHEMBL4490865 0.89 HDAC1 (0.73) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4497958 0.89 GSK3B (0.77) GSK3BHDAC1HDAC2HDAC8CYP1A2
SCHEMBL4501685 0.89 HDAC1 (0.76) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4483697 0.89 HDAC1 (0.69) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4486931 0.89 GSK3B (0.66) GSK3BHDAC1HDAC2HDAC8GSK3A
SCHEMBL4487680 0.88 GSK3B (0.84) GSK3BHDAC1HDAC2HDAC8GSK3A
SCHEMBL4487032 0.87 HDAC6 (0.64) GSK3BHDAC1HDAC2HDAC8HDAC6
SCHEMBL4493121 0.86 GSK3B (1.00) GSK3BHDAC1HDAC2HDAC8GSK3A
SCHEMBL31060453 0.86 GSK3B (1.00) GSK3BHDAC1HDAC2HDAC8GSK3A

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