SCHEMBL17629653

SCHEMBL17629653

CC(C)(C)C(NC(=O)c1c(O)c2c(n(Cc3ccc(C(F)(F)F)cc3)c1=O)COCC2)C(=O)O

nearest known ligand 0.72

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 17/20 0.72
EGLN2 Q96KS0 14/20 0.72
EGLN3 Q9H6Z9 14/20 0.72
CYSLTR2 Q9NS75 1/20 0.60
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
HPGD P15428 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
PTGER4 P35408 2/20 0.41

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
SCHEMBL17629658 0.98 EGLN1 (0.69) EGLN1EGLN2EGLN3CYSLTR2MEN1
SCHEMBL17629630 0.93 EGLN1 (0.72) EGLN1EGLN2EGLN3CYSLTR2MEN1
SCHEMBL17629576 0.84 EGLN1 (0.78) EGLN1EGLN2EGLN3CYSLTR2MEN1
SCHEMBL17629571 0.84 EGLN1 (1.00) EGLN1EGLN2EGLN3CYSLTR2
SCHEMBL20258261 0.82 EGLN1 (0.73) EGLN1EGLN2EGLN3CYSLTR2MEN1
SCHEMBL17633231 0.82 EGLN1 (0.73) EGLN1EGLN2EGLN3CYSLTR2
SCHEMBL17633230 0.82 EGLN1 (0.73) EGLN1EGLN2EGLN3CYSLTR2
SCHEMBL17629654 0.82 EGLN1 (0.80) EGLN1EGLN2EGLN3CYSLTR2
SCHEMBL17629642 0.82 EGLN1 (0.74) EGLN1EGLN2EGLN3CYSLTR2ALDH1A1
SCHEMBL17629619 0.81 EGLN1 (0.95) EGLN1EGLN2EGLN3CYSLTR2

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-3197455-A1 INHIBITORS OF HIF PROLYL HYDROXYLASE Merck Sharp & Dohme Corp. (US) 2017-08-02 EP disclosed
WO-2016049097-A1 INHIBITORS OF HIF PROLYL HYDROXYLASE MERCK SHARP & DOHME CORP. (US) 2016-03-31 WO disclosed