SCHEMBL4082616

SCHEMBL4082616

COC(=O)CNC(=O)c1nc(Cl)c2ccccc2c1O

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 10/20 0.76
FTO Q9C0B1 5/20 0.76
BBOX1 O75936 4/20 0.76
THRA P10827 4/20 0.58
THRB P10828 4/20 0.58
VEGFA P15692 1/20 0.49
FLT1 P17948 1/20 0.49
EGLN3 Q9H6Z9 1/20 0.49
SLC6A2 P23975 1/20 0.48
SLC6A3 Q01959 1/20 0.48
ASPH Q12797 1/20 0.48
KDM8 Q8N371 1/20 0.48

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
SCHEMBL25934724 0.86 EGLN1 (0.80) EGLN1FTOBBOX1THRATHRB
SCHEMBL29390250 0.86 EGLN1 (1.00) EGLN1FTOBBOX1THRATHRB
SCHEMBL522744 0.86 EGLN1 (1.00) EGLN1FTOBBOX1THRATHRB
SCHEMBL523982 0.86 EGLN1 (0.55) EGLN1FTOBBOX1THRATHRB
SCHEMBL28567789 0.84 THRA (0.84) EGLN1FTOBBOX1THRATHRB
SCHEMBL523025 0.84 EGLN1 (0.67) EGLN1FTOBBOX1THRATHRB
SCHEMBL522478 0.84 EGLN1 (0.56) EGLN1FTOBBOX1THRATHRB
SCHEMBL522875 0.82 THRA (0.64) EGLN1FTOBBOX1THRATHRB
SCHEMBL31028948 0.82 THRA (0.64) EGLN1FTOBBOX1THRATHRB
SCHEMBL12896198 0.81 EGLN1 (0.80) EGLN1FTOBBOX1THRATHRB

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-1538160-B1 Substituted Isoquinolin-3-carboxyamides, their preparation and medical use FIBROGEN INC (US) 2009-06-03 EP disclosed
US-6093730-A AN ENZYME INHIBITORS OF PROLYL-4-HYDROXYLASE FOR TREATING FIBROTIC DISORDERS AND INHIBITING COLLAGEN BIOSYNTHESIS HOECHST MARION ROUSSEL DEUTSCHLAND GMBH (DE) 2000-07-25 US disclosed