SCHEMBL4485328

SCHEMBL4485328

CCC(=O)Nc1n[nH]c2cc(-c3cccc(OC)c3)ccc12

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC1 Q13547 8/20 0.76
HDAC2 Q92769 8/20 0.76
HDAC8 Q9BY41 8/20 0.76
HDAC6 Q9UBN7 4/20 0.69
GSK3B P49841 4/20 0.64
FGFR1 P11362 2/20 0.62
FGFR2 P21802 2/20 0.62
FGFR3 P22607 2/20 0.62
FGFR4 P22455 2/20 0.61
CYP1A2 P05177 1/20 0.58

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
SCHEMBL4487017 0.92 HDAC1 (0.81) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4501685 0.91 HDAC1 (0.76) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4497413 0.90 HDAC1 (0.73) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4498073 0.88 HDAC1 (0.72) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4494397 0.87 HDAC6 (0.73) HDAC1HDAC2HDAC8HDAC6FGFR1
SCHEMBL4492088 0.87 HDAC1 (0.71) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4482771 0.87 HDAC1 (0.67) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4487680 0.86 GSK3B (0.84) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4490399 0.86 HDAC1 (0.92) HDAC1HDAC2HDAC8HDAC6GSK3B
SCHEMBL4492950 0.85 HDAC1 (0.65) HDAC1HDAC2HDAC8HDAC6GSK3B

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