SCHEMBL2913845

SCHEMBL2913845

COc1c(-c2cccc(Cl)c2)cc(-n2c(=O)cc[nH]c2=O)cc1-c1ccc2cc(NS(C)(=O)=O)ccc2c1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CRBN Q96SW2 1/20 0.49
MET P08581 1/20 0.39
BRD4 O60885 5/20 0.38
NR3C1 P04150 1/20 0.38
PGR P06401 1/20 0.38
NR3C2 P08235 1/20 0.38
AR P10275 1/20 0.38
SCN9A Q15858 7/20 0.37
TDP2 O95551 1/20 0.36
PTK2 Q05397 1/20 0.35
CYP2C9 P11712 1/20 0.35
JAK2 O60674 1/20 0.35
JAK1 P23458 1/20 0.35
TYK2 P29597 1/20 0.35
JAK3 P52333 1/20 0.35
PDGFRB P09619 1/20 0.35
KIT P10721 1/20 0.35
KDR P35968 1/20 0.35
HSP90AA1 P07900 1/20 0.35
HSP90AB1 P08238 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
SCHEMBL2914093 0.91 CRBN (0.52) CRBNMETBRD4JAK2JAK1
SCHEMBL2913138 0.87 CRBN (0.53) CRBNBRD4PTK2JAK2JAK1
SCHEMBL2913874 0.86 CRBN (0.54) CRBNBRD4JAK2JAK1TYK2
SCHEMBL2915591 0.86 CRBN (0.52) CRBNBRD4JAK2JAK1TYK2
SCHEMBL2911158 0.86 CRBN (0.52) CRBNBRD4JAK2JAK1TYK2
SCHEMBL2910084 0.85 CRBN (0.48) CRBNBRD4SCN9ACYP2C9JAK2
SCHEMBL2913210 0.85 CRBN (0.48) CRBNBRD4NR3C1PTK2JAK2
SCHEMBL2910644 0.85 CRBN (0.49) CRBNMETBRD4SCN9AJAK2
SCHEMBL2915237 0.85 CRBN (0.49) CRBNMETBRD4NR3C1PTK2
SCHEMBL2913931 0.84 CRBN (0.69) CRBNBRD4NR3C1ARJAK2

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-2222646-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C Abbott Laboratories (US) 2010-09-01 EP disclosed
EP-2203431-A1 ANTI-INFECTIVE PYRIMIDINES AND USES THEREOF Abbott Laboratories (US) 2010-07-07 EP disclosed
WO-2009039127-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed
WO-2009039134-A1 ANTI-INFECTIVE PYRIMIDINES AND USES THEREOF ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed