SCHEMBL28293751

SCHEMBL28293751

CC(OC=O)C(=O)CC(=O)O

nearest known ligand 0.36

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
FOLH1 Q04609 1/20 0.36
LDHA P00338 1/20 0.33
SRR Q9GZT4 1/20 0.33

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
SCHEMBL28793552 0.77
SCHEMBL262554 0.75 LDHA (0.38) LDHASRR
SCHEMBL21294536 0.75 LDHA (0.38) LDHASRR
SCHEMBL18221136 0.74
SCHEMBL10011710 0.74
SCHEMBL2780541 0.74
SCHEMBL13555632 0.73
SCHEMBL10554240 0.71 SLC22A6 (0.35) FOLH1
SCHEMBL10878756 0.71 SLC22A6 (0.35) FOLH1
SCHEMBL11160781 0.71 SLC22A6 (0.35) FOLH1

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-105968156-B A kind of αisomer impurity of Rui Jianuosheng and its preparation method and application 南京海融医药科技股份有限公司 2019-05-24 CN claimed