SCHEMBL1980286

SCHEMBL1980286

CC(C)c1cccc(Oc2ncc(NC(=O)[C@](C)(NC(=O)O)C(C)(C)C)cn2)c1

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CASP1 P29466 1/20 0.39
RORC P51449 1/20 0.39
BRAF P15056 1/20 0.38
PTGS1 P23219 1/20 0.37
FFAR1 O14842 1/20 0.37
NPY5R Q15761 1/20 0.36
ALDH1A1 P00352 2/20 0.36
SMN1; SMN2 Q16637 2/20 0.36
KDM4E B2RXH2 1/20 0.36
LMNA P02545 1/20 0.36
KDR P35968 2/20 0.35
TEK Q02763 2/20 0.35
CDK8 P49336 1/20 0.35
ACACB O00763 1/20 0.35
RAB9A P51151 2/20 0.35
NPC1 O15118 1/20 0.35
TP53 P04637 1/20 0.35
FLT3 P36888 1/20 0.35
MEN1 O00255 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL1984297 0.88 RAB9A (0.46) ALDH1A1KDM4EACACBRAB9AMEN1
SCHEMBL17350123 0.79 RORC (0.41) CASP1RORCBRAFPTGS1FFAR1
SCHEMBL1982041 0.77 XIAP (0.44) CASP1RORCBRAFPTGS1FFAR1
SCHEMBL1978975 0.77 RAB9A (0.48) ALDH1A1KDM4EACACBRAB9ANPC1
SCHEMBL21980919 0.77 CASP1 (0.41) CASP1RORCBRAFPTGS1FFAR1
SCHEMBL13720514 0.77 CASP1 (0.41) CASP1RORCBRAFPTGS1FFAR1
SCHEMBL1979333 0.75 RAB9A (0.43) RORCFFAR1ALDH1A1KDM4EACACB
SCHEMBL13832422 0.75 JAK2 (0.41) CASP1RORCBRAFKDM4EMEN1
SCHEMBL1982040 0.73 SYK (0.44) CASP1RORCBRAFPTGS1ALDH1A1
SCHEMBL17354614 0.72 RXRA (0.48) RORCPTGS1ALDH1A1SMN1; SMN2KDM4E

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2509961-A1 IMIDAZOLIDINEDIONE DERIVATIVES Autifony Therapeutics Limited (GB) 2012-10-17 EP disclosed
WO-2011069951-A1 IMIDAZOLIDINEDIONE DERIVATIVES GLAXO GROUP LIMITED (GB) 2011-06-16 WO disclosed