SCHEMBL4491013

SCHEMBL4491013

Cc1cccc(C)c1-c1ccc2c(NC(=O)c3c(F)cccc3Cl)n[nH]c2c1

nearest known ligand 0.59

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 10/20 0.59
GSK3B P49841 3/20 0.49
GSK3A P49840 1/20 0.48
L3MBTL1 Q9Y468 1/20 0.47
MAOB P27338 1/20 0.46
RXFP1 Q9HBX9 1/20 0.46
AAK1 Q2M2I8 1/20 0.46
FGFR1 P11362 1/20 0.46
FGFR2 P21802 1/20 0.46
FGFR3 P22607 1/20 0.46

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
SCHEMBL4493989 0.94 HDAC6 (0.55) HDAC6GSK3BGSK3AAAK1FGFR1
SCHEMBL4489469 0.91 HDAC6 (0.57) HDAC6GSK3BGSK3AL3MBTL1FGFR1
SCHEMBL4486581 0.89 HDAC6 (0.60) HDAC6GSK3BGSK3ARXFP1AAK1
SCHEMBL4485957 0.89 HDAC6 (0.53) HDAC6GSK3BGSK3AFGFR1FGFR2
SCHEMBL4483427 0.88 HDAC6 (0.52) HDAC6GSK3BGSK3ARXFP1FGFR1
SCHEMBL4488764 0.87 HDAC6 (0.66) HDAC6GSK3BGSK3AAAK1
SCHEMBL4500056 0.85 HDAC6 (0.55) HDAC6GSK3BGSK3AFGFR1FGFR2
SCHEMBL4488922 0.84 GSK3B (0.64) HDAC6GSK3BGSK3AFGFR1FGFR2
SCHEMBL4480304 0.83 HDAC6 (0.59) HDAC6GSK3BGSK3AFGFR1FGFR2
SCHEMBL4490781 0.83 HDAC6 (0.67) HDAC6GSK3BFGFR1FGFR2FGFR3

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