SCHEMBL21340136

SCHEMBL21340136

O=C(O)C(O)C(O)(CO)CCO

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CPT2 P23786 1/20 0.39
ACLY P53396 1/20 0.39
OR51E2 Q9H255 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
SCHEMBL29706712 0.85 CPT2 (0.44) CPT2ACLYOR51E2
SCHEMBL28778991 0.76 CPT2 (0.41) CPT2ACLYOR51E2
SCHEMBL30661647 0.73 CPT2 (0.39) CPT2ACLYOR51E2
SCHEMBL27796274 0.72
SCHEMBL29257726 0.70 CPT2 (0.44) CPT2ACLYOR51E2
SCHEMBL14809482 0.69 CPT2 (0.43) CPT2ACLYOR51E2
SCHEMBL722576 0.67 ACLY (0.64) CPT2ACLYOR51E2
SCHEMBL29482688 0.67 ACLY (0.64) CPT2ACLYOR51E2
SCHEMBL7705028 0.66 CHRNB2 (0.32)
SCHEMBL344139 0.65 ALDH1A1 (0.43) CPT2ACLY

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3509578-B1 MONOMERIC BIMETAL HYDROXYCITRIC ACID COMPOUNDS AND METHODS OF MAKING AND USING THE SAME GLYKON TECH GROUP LLC (US) 2022-12-21 EP disclosed
WO-2019173150-A1 HYDROXYCITRIC ACID METAL HETEROCYCLIC COMPOUNDS WITH COVALENT CHARACTERISTICS GLYKON TECHNOLOGIES GROUP, LLC (US) 2019-09-12 WO disclosed