SCHEMBL6153847

SCHEMBL6153847

COC(=O)CC(CC(=O)OC)C(=O)OCc1ccc(Cl)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.46
MEN1 O00255 3/20 0.46
MAPT P10636 3/20 0.46
KMT2A Q03164 3/20 0.46
NPSR1 Q6W5P4 2/20 0.46
ALDH1A1 P00352 5/20 0.45
HTT P42858 1/20 0.45
POLB P06746 2/20 0.45
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44
CA9 Q16790 2/20 0.44
MMP2 P08253 1/20 0.44
CACNA1B Q00975 1/20 0.44
L3MBTL1 Q9Y468 3/20 0.43
CYP1A2 P05177 1/20 0.43
CYP3A4 P08684 1/20 0.43
CYP2C9 P11712 1/20 0.43
CYP2C19 P33261 1/20 0.43
MAPK1 P28482 1/20 0.42
RAB9A P51151 1/20 0.41

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
SCHEMBL6153075 0.86 KMT2A (0.44) GAAMAPTKMT2AALDH1A1CA1
SCHEMBL6156492 0.84 KMT2A (0.48) MEN1MAPTKMT2AALDH1A1POLB
SCHEMBL6156785 0.84 ALDH1A1 (0.52) GAAMAPTKMT2AALDH1A1HTT
SCHEMBL6155864 0.84 KMT2A (0.48) GAAMEN1MAPTKMT2AALDH1A1
SCHEMBL6153292 0.82 ALDH1A1 (0.53) MEN1KMT2AALDH1A1HTTMMP2
SCHEMBL16798274 0.81 KMT2A (0.49) MEN1KMT2AALDH1A1POLBL3MBTL1
SCHEMBL27972311 0.80 MEN1 (0.52) GAAMEN1MAPTKMT2ANPSR1
SCHEMBL6153746 0.80 GAA (0.52) GAAMAPTALDH1A1HTTL3MBTL1
SCHEMBL16798257 0.78 KMT2A (0.62) MEN1KMT2AALDH1A1L3MBTL1CYP1A2
SCHEMBL6153567 0.77 ALDH1A1 (0.49) MEN1MAPTKMT2AALDH1A1HTT

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
US-20050119341-A1 3-substituted oxyglutaric diester compound, optically active 3-substituted oxyglutaric monoester compound, and processes for producing these UBE INDUSTRIES, LTD. (JP) 2005-06-02 US disclosed
EP-1500642-A1 3-SUBSTITUTED OXYGLUTARIC DIESTER COMPOUND, OPTICALLY ACTIVE 3-SUBSTITUTED OXYGLUTARIC MONOESTER COMPOUND, AND PROCESSES FOR PRODUCING THESE Ube Industries, Ltd. (JP) 2005-01-26 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20050119341-A1 3-substituted oxyglutaric diester compound, optically active 3-substituted oxyglutaric monoester compound, and processes for producing these OGDH, GLUL, ADSL GAA 157/4885MEN1 2902/4885MAPT 3886/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.