SCHEMBL14949872

SCHEMBL14949872

CC(C)(C)OC(=O)CNC(=O)c1c(O)c2c(n(Cc3ccc(Br)cc3)c1=O)CSC2

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 17/20 0.48
EGLN3 Q9H6Z9 12/20 0.48
EGLN2 Q96KS0 11/20 0.48
CYSLTR2 Q9NS75 1/20 0.45
MEN1 O00255 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
KMT2A Q03164 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37

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
SCHEMBL12917891 0.87 EGLN1 (0.46) EGLN1EGLN3EGLN2CYSLTR2ALDH1A1
SCHEMBL963003 0.87 EGLN1 (0.59) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL19531502 0.86 EGLN1 (0.55) EGLN1EGLN3EGLN2
SCHEMBL19518391 0.86 EGLN1 (0.58) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL13017097 0.85 EGLN1 (0.66) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL17629656 0.83 EGLN1 (0.64) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL960004 0.80 EGLN1 (0.64) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL14685855 0.80 EGLN1 (0.44) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL962259 0.79 EGLN1 (0.59) EGLN1EGLN3EGLN2CYSLTR2
SCHEMBL12917909 0.79 EGLN1 (0.59) EGLN1EGLN3EGLN2CYSLTR2

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-2257169-B1 TETRAHYDROTHIENO PYRIDINES MERCK SHARP & DOHME (US) 2013-06-05 EP disclosed
US-8445680-B2 Tetrahydrothieno pyridines MERCK SHARP & DOHME CORP. (US) 2013-05-21 US disclosed