SCHEMBL15713541

SCHEMBL15713541

CC1COCC(=O)N1c1ccc(N)nc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HDAC6 Q9UBN7 2/20 0.39
HDAC1 Q13547 1/20 0.39
HDAC8 Q9BY41 1/20 0.39
HDAC5 Q9UQL6 1/20 0.39
MTOR P42345 11/20 0.36
DRD2 P14416 4/20 0.36
DRD3 P35462 4/20 0.36
DRD4 P21917 1/20 0.36
PIK3CA P42336 8/20 0.35
PIK3R1 P27986 4/20 0.35
RICTOR Q6R327 4/20 0.35
RPTOR Q8N122 4/20 0.35
MAPKAP1 Q9BPZ7 4/20 0.35
MLST8 Q9BVC4 4/20 0.35
PIK3CD O00329 1/20 0.35
PIK3CB P42338 1/20 0.35
PIK3CG P48736 1/20 0.35
PIK3C3 Q8NEB9 1/20 0.35
CHEK1 O14757 1/20 0.35
ATR Q13535 1/20 0.35

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
SCHEMBL17689121 0.84 HDAC6 (0.40) HDAC6HDAC1HDAC8HDAC5MTOR
SCHEMBL17688867 0.81 HDAC6 (0.40) HDAC6HDAC1HDAC8HDAC5MTOR
SCHEMBL18929983 0.79 HDAC6 (0.37) HDAC6HDAC1HDAC8HDAC5
SCHEMBL24374810 0.76 CHRNB2 (0.40) MTORDRD2DRD3DRD4PIK3CA
SCHEMBL30316567 0.76 MTOR (0.44) MTORDRD2DRD3DRD4PIK3CA
SCHEMBL30315969 0.76 MTOR (0.44) MTORDRD2DRD3DRD4PIK3CA
SCHEMBL17108489 0.76 MTOR (0.44) MTORDRD2DRD3DRD4PIK3CA
SCHEMBL17108491 0.76 MTOR (0.44) MTORDRD2DRD3DRD4PIK3CA
SCHEMBL18291497 0.75 SLC6A2 (0.41) DRD2DRD3DRD4CHRNB2CHRNA4
SCHEMBL29348974 0.75 MEN1 (0.38)

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2922841-B1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFN ALPHA RESPONSES BRISTOL MYERS SQUIBB CO (US) 2017-06-07 EP disclosed
US-9315494-B2 Alkyl-amide-substituted pyridyl compounds useful as modulators of IL-12, IL-23 and/or IFNα responses BRISTOL-MYERS SQUIBB COMPANY (US) 2016-04-19 US disclosed
US-9315494-B2 Alkyl-amide-substituted pyridyl compounds useful as modulators of IL-12, IL-23 and/or IFNα responses BRISTOL-MYERS SQUIBB COMPANY (US) 2016-04-19 US disclosed
WO-2014074660-A1 ALKYL-AMIDE-SUBSTITUTED PYRIDYL COMPOUNDS USEFUL AS MODULATORS OF IL-12, IL-23 AND/OR IFNα RESPONSES BRISTOL-MYERS SQUIBB COMPANY (US) 2014-05-15 WO disclosed