SCHEMBL2910585

SCHEMBL2910585

CO/C(=C\c1cc(N2C(=O)CCNC2=O)cc(C(C)(C)C)c1OC)c1ccc(NS(C)(=O)=O)cc1

nearest known ligand 0.40

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
CYP3A4 P08684 3/20 0.40
CRBN Q96SW2 1/20 0.38
ADRB1 P08588 2/20 0.33
WDR5 P61964 1/20 0.31

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
SCHEMBL2909904 0.92 CYP3A4 (0.40) CYP3A4CRBNADRB1WDR5
SCHEMBL2914330 0.91 CYP3A4 (0.40) CYP3A4CRBNADRB1WDR5
SCHEMBL2910588 0.91 CYP3A4 (0.40) CYP3A4CRBNADRB1WDR5
SCHEMBL2906898 0.91 CYP3A4 (0.40) CYP3A4CRBNADRB1WDR5
SCHEMBL2913880 0.85 CYP3A4 (0.56) CYP3A4CRBN
SCHEMBL2913728 0.85 CYP3A4 (0.56) CYP3A4CRBN
SCHEMBL2915916 0.82 CRBN (0.39) CYP3A4CRBNADRB1WDR5
SCHEMBL2910562 0.82 HPGD (0.41) CYP3A4CRBNADRB1
SCHEMBL1530128 0.82 CYP3A4 (0.40) CYP3A4CRBNADRB1WDR5
SCHEMBL10254310 0.82 CYP3A4 (0.40) CYP3A4CRBNADRB1WDR5

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-2203430-A1 N-PHENYL-DIOXO-HYDROPYRIMIDINES USEFUL AS HEPATITIS C VIRUS (HCV) INHIBITORS Abbott Laboratories (US) 2010-07-07 EP disclosed
WO-2009039135-A1 N-PHENYL-DIOXO-HYDROPYRIMIDINES USEFUL AS HEPATITIS C VIRUS (HCV) INHIBITORS ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed
WO-2009039127-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed