SCHEMBL6892516

SCHEMBL6892516

C#CCCC(C)(C)COC(=O)NCC(=O)O

nearest known ligand 0.33

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 2/20 0.33
MEN1 O00255 1/20 0.31
KMT2A Q03164 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
SCHEMBL6894145 0.75 TSHR (0.33)
SCHEMBL7926967 0.72 EGLN1 (0.35) EGLN1
SCHEMBL12187907 0.71 CTSK (0.33)
SCHEMBL16447016 0.71 EGLN1 (0.38) EGLN1MEN1KMT2A
SCHEMBL10041806 0.68 LMNA (0.45) EGLN1
SCHEMBL8868949 0.68 EGLN1 (0.38) EGLN1
SCHEMBL29172779 0.66 KMT2A (0.41) KMT2A
SCHEMBL578668 0.66 LMNA (0.68) EGLN1
SCHEMBL11314635 0.65 EGLN1 (0.49) EGLN1MEN1KMT2A
SCHEMBL1912605 0.65 EGLN1 (0.63) EGLN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011025849-A1 PROCESSES FOR PREPARING PROTEASE INHIBITORS OF HEPATITIS C VIRUS MERCK SHARP & DOHME CORP. (US) 2011-03-03 WO disclosed