SCHEMBL28005454

SCHEMBL28005454

O=C(CC(=O)C(=O)OCl)OCl

nearest known ligand 0.32

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.32
GAA P10253 1/20 0.32
SI P14410 1/20 0.32
MGAM2 Q2M2H8 1/20 0.32

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
SCHEMBL3985200 0.78
SCHEMBL27360133 0.78 OR51E2 (0.36)
SCHEMBL28794549 0.78 MGAM (0.43) MGAMGAASIMGAM2
SCHEMBL27957079 0.76 MGAM (0.38) MGAMGAASIMGAM2
SCHEMBL1686712 0.74
SCHEMBL1888722 0.74 ALDH1A1 (0.35)
SCHEMBL13393789 0.73 TSHR (0.33) MGAMGAASIMGAM2
SCHEMBL8044345 0.71
SCHEMBL9158669 0.71
SCHEMBL6027567 0.69

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-104447527-A Method for preparing pyridine-2,3-dicarboxylic ester compound SINOCHEM CORP 2015-03-25 CN disclosed