SCHEMBL28004744

SCHEMBL28004744

O=C(N[C@@H](CO)C(=O)O)c1nc(Cl)c2ccccc2c1O.O=C(N[C@H](CO)C(=O)O)c1nc(Cl)c2ccccc2c1O

nearest known ligand 0.80

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ FTO Q9C0B1 4/20 0.78
▸ EGLN1 Q9GZT9 7/20 0.69
▸ BBOX1 O75936 5/20 0.69
▸ THRA P10827 1/20 0.46
▸ THRB P10828 1/20 0.46
▸ CA1 P00915 1/20 0.40
▸ CA2 P00918 1/20 0.40
▸ EGLN2 Q96KS0 1/20 0.39

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
SCHEMBL522707 1.00 FTO (0.78) FTOEGLN1BBOX1THRATHRB
SCHEMBL523829 1.00 FTO (0.78) FTOEGLN1BBOX1THRATHRB
SCHEMBL522706 1.00 FTO (0.78) FTOEGLN1BBOX1THRATHRB
SCHEMBL523083 0.89 FTO (0.76) FTOEGLN1BBOX1THRATHRB
SCHEMBL522082 0.89 FTO (0.76) FTOEGLN1BBOX1THRATHRB
SCHEMBL522083 0.89 FTO (0.76) FTOEGLN1BBOX1THRATHRB
SCHEMBL523475 0.88 FTO (1.00) FTOEGLN1BBOX1
SCHEMBL29619835 0.88 FTO (1.00) FTOEGLN1BBOX1
SCHEMBL523353 0.88 FTO (1.00) FTOEGLN1BBOX1
SCHEMBL523354 0.88 FTO (1.00) FTOEGLN1BBOX1

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-104427980-A Treatment for high cholesterol FIBROGEN INC 2015-03-18 — — CN disclosed
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