SCHEMBL2913638

SCHEMBL2913638

COc1c(C#Cc2ccc(NS(C)(=O)=O)c(C(F)(F)F)c2)cc(N2C(=O)CCNC2=O)cc1C(C)(C)C

nearest known ligand 0.35

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 1/20 0.35
EGFR P00533 1/20 0.34
CRBN Q96SW2 1/20 0.32

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
SCHEMBL2910760 0.91 CRBN (0.33) CRBN
SCHEMBL2913397 0.90 CRBN (0.33) CRBN
SCHEMBL2912863 0.90 EGFR (0.31) EGFRCRBN
SCHEMBL2915214 0.90 CRBN (0.33) HTR6EGFRCRBN
SCHEMBL2915572 0.87 CRBN (0.40) CRBN
SCHEMBL2912404 0.85 CRBN (0.39) CRBN
SCHEMBL2913326 0.85 CRBN (0.38) CRBN
SCHEMBL2912660 0.84 CRBN (0.32) CRBN
SCHEMBL1530959 0.82 CRBN (0.36) HTR6EGFRCRBN
SCHEMBL2914780 0.82 CRBN (0.32) CRBN

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-2222646-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C Abbott Laboratories (US) 2010-09-01 EP disclosed
WO-2009039127-A1 URACIL OR THYMINE DERIVATIVE FOR TREATING HEPATITIS C ABBOTT LABORATORIES (US) 2009-03-26 WO disclosed