SCHEMBL1809767

SCHEMBL1809767

O=C(O)CNC(=O)c1nc(Cl)c2c(sc3ccc(Cl)nc32)c1O

nearest known ligand 0.67

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 19/20 0.67
FTO Q9C0B1 3/20 0.50
BBOX1 O75936 1/20 0.50
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
EGLN2 Q96KS0 1/20 0.37
EGLN3 Q9H6Z9 2/20 0.37
KDM5B Q9UGL1 1/20 0.37
KDM2A Q9Y2K7 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
SCHEMBL1810773 0.84 EGLN1 (0.71) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269880 0.81 EGLN1 (0.76) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269131 0.81 EGLN1 (1.00) EGLN1FTOBBOX1THRATHRB
SCHEMBL1270239 0.79 EGLN1 (0.73) EGLN1FTOBBOX1THRATHRB
SCHEMBL1270012 0.79 EGLN1 (0.73) EGLN1FTOBBOX1THRATHRB
SCHEMBL1270251 0.79 EGLN1 (0.76) EGLN1FTOBBOX1THRATHRB
SCHEMBL1809219 0.78 EGLN1 (0.68) EGLN1FTOBBOX1THRATHRB
SCHEMBL1268876 0.78 EGLN1 (0.71) EGLN1FTOBBOX1THRATHRB
SCHEMBL1269966 0.77 EGLN1 (0.73) EGLN1FTOBBOX1THRATHRB
SCHEMBL23493314 0.77 EGLN1 (0.65) 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
WO-2011056725-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2011-05-12 WO claimed
WO-2011056725-A1 PYRIDINE DERIVATIVES AND METHODS OF USE THEREOF CRYSTALGENOMICS, INC. (KR) 2011-05-12 WO disclosed