Sugi Predict

Sugi Predict / Compounds / Oxaloacetate

Oxaloacetate

Oxaloacetate

SCHEMBL3490722

O=C(O)/C=C/C(=O)OC(CC(=O)O)C(=O)O.O=C(O)CC(=O)C(=O)O

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ HCAR2 Q8TDS4 6/20 0.41
▸ PYGL P06737 1/20 0.30

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
SCHEMBL3716837 0.88 HCAR2 (0.50) HCAR2PYGL
SCHEMBL646453 0.88 HCAR2 (0.50) HCAR2PYGL
Succinic Acid SCHEMBL465927 0.83 HCAR2 (0.46) HCAR2PYGL
SCHEMBL28120698 0.83 HCAR2 (0.40) HCAR2PYGL
SCHEMBL9136836 0.81 HCAR2 (0.41) HCAR2PYGL
Oxaloacetate SCHEMBL3490724 0.75 SMN1; SMN2 (0.56) —
SCHEMBL26102844 0.73 MMP1 (0.36) HCAR2PYGL
SCHEMBL19119832 0.72 HCAR2 (0.44) HCAR2
SCHEMBL19107081 0.72 HCAR2 (0.44) HCAR2
SCHEMBL2048611 0.72 TDP1 (0.36) —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-9234218-B2 Process for preparing methacrylic acid or methacrylic esters EVONIK ROEHM GMBH (DE) 2016-01-12 — — US disclosed
US-20150218601-A1 MICROBIOLOGICAL PRODUCTION OF 3-HYDROXYISOBUTYRIC ACID EVONIK ROEHM GMBH (DE) 2015-08-06 — — US disclosed
US-20100291644-A1 PROCESS FOR PREPARING METHACRYLIC ACID OR METHACRYLIC ESTERS EVONIK ROEHM GMBH (DE) 2010-11-18 — — US disclosed
US-20100068773-A1 MICROBIOLOGICAL PRODUCTION OF 3-HYDROXYISOBUTYRIC ACID EVONIK ROEHM GMBH (DE) 2010-03-18 — — US disclosed