SCHEMBL5379770

SCHEMBL5379770

O=C(O)CN(CC(=O)O)c1ccccc1C(=O)c1nc(Cl)c2ccccc2c1O

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EGLN1 Q9GZT9 7/20 0.53
BBOX1 O75936 5/20 0.53
FTO Q9C0B1 4/20 0.53
THRA P10827 1/20 0.39
THRB P10828 1/20 0.39
CNR2 P34972 1/20 0.38
TDP1 Q9NUW8 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
SCHEMBL523061 0.77 EGLN1 (0.60) EGLN1BBOX1FTOTHRATHRB
SCHEMBL523708 0.74 EGLN1 (0.58) EGLN1BBOX1FTOTHRATHRB
SCHEMBL5379776 0.74 EGLN1 (0.46) EGLN1BBOX1FTOTHRATHRB
SCHEMBL522787 0.72 EGLN1 (0.65) EGLN1BBOX1FTOTHRATHRB
SCHEMBL29390250 0.70 EGLN1 (1.00) EGLN1BBOX1FTOTHRATHRB
SCHEMBL522744 0.70 EGLN1 (1.00) EGLN1BBOX1FTOTHRATHRB
SCHEMBL30580347 0.69 TDP1 (0.56) TDP1
SCHEMBL129880 0.69 TDP1 (0.56) TDP1
SCHEMBL2015310 0.68 EGLN1 (0.59) EGLN1BBOX1FTOTHRATHRB
SCHEMBL27773936 0.68 EGLN1 (0.59) EGLN1BBOX1FTOTHRATHRB

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-2007047194-A2 METHODS FOR TREATING MITF-RELATED DISORDERS DANA-FARBER CANCER INSTITUTE, INC. (US) 2007-04-26 WO disclosed