SCHEMBL4481808

SCHEMBL4481808

CC(Oc1ccccc1)C(=O)Nc1n[nH]c2cc(-c3ccccc3F)ccc12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 5/20 0.59
HDAC1 Q13547 4/20 0.56
HDAC2 Q92769 4/20 0.56
HDAC8 Q9BY41 4/20 0.56
FGFR4 P22455 2/20 0.48
GSK3B P49841 5/20 0.48
FGFR1 P11362 3/20 0.47
FGFR2 P21802 3/20 0.47
FGFR3 P22607 3/20 0.47
ADORA3 P0DMS8 1/20 0.47
ADORA2A P29274 1/20 0.47
ADORA1 P30542 1/20 0.47
GSK3A P49840 1/20 0.45
MEN1 O00255 1/20 0.45
KMT2A Q03164 1/20 0.45
ATM Q13315 1/20 0.45

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
SCHEMBL4480882 0.92 GSK3B (0.59) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4505048 0.92 GSK3B (0.49) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4487636 0.89 HDAC6 (0.52) HDAC6GSK3BFGFR1FGFR2FGFR3
SCHEMBL4503333 0.88 GSK3B (0.58) HDAC6HDAC1HDAC2HDAC8GSK3B
SCHEMBL4496312 0.88 GSK3B (0.60) HDAC6HDAC1HDAC2HDAC8GSK3B
SCHEMBL4502109 0.87 HDAC6 (0.63) HDAC6HDAC1HDAC2HDAC8FGFR4
SCHEMBL4486296 0.87 HDAC6 (0.49) HDAC6GSK3BFGFR1FGFR2FGFR3
SCHEMBL4496491 0.87 HDAC6 (0.47) HDAC6HDAC1HDAC2HDAC8GSK3B
SCHEMBL4485505 0.86 GSK3B (0.59) HDAC6HDAC1HDAC2HDAC8GSK3B
SCHEMBL4503997 0.85 HDAC6 (0.63) HDAC6HDAC1HDAC2HDAC8FGFR4

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