SCHEMBL6153075

SCHEMBL6153075

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

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 1/20 0.44
NPC1 O15118 2/20 0.44
RAB9A P51151 2/20 0.44
MAPT P10636 2/20 0.44
ALDH1A1 P00352 3/20 0.42
NAAA Q02083 1/20 0.42
MMP2 P08253 2/20 0.41
MMP12 P39900 2/20 0.41
CA1 P00915 1/20 0.41
CA2 P00918 1/20 0.41
MMP1 P03956 1/20 0.41
MMP9 P14780 1/20 0.41
ABCB1 P08183 1/20 0.41
GAA P10253 1/20 0.41
MAPK1 P28482 1/20 0.40
ATM Q13315 1/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
LMNA P02545 1/20 0.40
P2RX4 Q99571 1/20 0.40

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
SCHEMBL6156785 0.86 ALDH1A1 (0.52) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL6155864 0.86 KMT2A (0.48) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL6156492 0.86 KMT2A (0.48) KMT2AMAPTALDH1A1CA1CA2
SCHEMBL6153847 0.86 GAA (0.46) KMT2ARAB9AMAPTALDH1A1MMP2
SCHEMBL6154497 0.82 POLB (0.53) KMT2AALDH1A1MMP2MMP12MMP9
SCHEMBL6153746 0.81 GAA (0.52) RAB9AMAPTALDH1A1GAAMAPK1
SCHEMBL31538455 0.80 CA1 (0.49) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL25509839 0.79 NPC1 (0.51) KMT2ANPC1RAB9AMAPTALDH1A1
SCHEMBL9574213 0.78 ABCB1 (0.57) ALDH1A1ABCB1MAPK1L3MBTL1
SCHEMBL6576006 0.76 HSD17B10 (0.52) ALDH1A1MMP1ABCB1

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 KMT2A 2290/4885NPC1 4217/4885RAB9A 3213/4885

“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.