SCHEMBL28095466

SCHEMBL28095466

NC(=O)CO.O=C(O)c1nc(Cl)c2ccccc2c1O

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 8/20 0.58
BBOX1 O75936 5/20 0.58
FTO Q9C0B1 4/20 0.58
THRA P10827 1/20 0.42
THRB P10828 1/20 0.42
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
MAPT P10636 1/20 0.40
PKM P14618 1/20 0.40
HPGD P15428 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40
PRNP P04156 1/20 0.38

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
SCHEMBL522787 0.89 EGLN1 (0.65) EGLN1BBOX1FTOTHRATHRB
SCHEMBL28095852 0.85 EGLN1 (0.52) EGLN1BBOX1FTOTHRATHRB
SCHEMBL27773936 0.81 EGLN1 (0.59) EGLN1BBOX1FTOTHRATHRB
SCHEMBL522789 0.77 EGLN1 (0.52) EGLN1BBOX1FTOKDM4EMEN1
SCHEMBL2015310 0.74 EGLN1 (0.59) EGLN1BBOX1FTOTHRATHRB
SCHEMBL522744 0.73 EGLN1 (1.00) EGLN1BBOX1FTOTHRATHRB
SCHEMBL29390250 0.73 EGLN1 (1.00) EGLN1BBOX1FTOTHRATHRB
SCHEMBL523061 0.72 EGLN1 (0.60) EGLN1BBOX1FTOTHRATHRB
SCHEMBL522788 0.72 EGLN1 (0.72) EGLN1BBOX1FTOTHRATHRB
SCHEMBL6060435 0.72 ALDH1A1 (0.47) EGLN1BBOX1FTOTHRBKDM4E

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
CN-101242817-B HIF1 alpha modulators purposes in treatment cancer 菲布罗根公司 2016-08-31 CN disclosed