SCHEMBL7015253

SCHEMBL7015253

CCOC(=O)[C@H](CCC(=O)OC(C)(C)C)NC(=O)OCc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SYK P43405 1/20 0.55
BCHE P06276 2/20 0.52
ACHE P22303 2/20 0.52
CACNA1F O60840 1/20 0.52
CACNA1D Q01668 1/20 0.52
CACNA1S Q13698 1/20 0.52
CACNA1C Q13936 1/20 0.52
CTSK P43235 5/20 0.49
CTSL P07711 2/20 0.48
CTSS P25774 2/20 0.48
CTSB P07858 1/20 0.48
SIRT2 Q8IXJ6 2/20 0.48
SIRT1 Q96EB6 2/20 0.48
PPARA Q07869 1/20 0.47
MAPT P10636 1/20 0.46
SIRT3 Q9NTG7 1/20 0.46
CASP1 P29466 1/20 0.46

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
SCHEMBL31294616 1.00 SYK (0.55) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL29336406 0.94 SYK (0.55) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL29336412 0.94 SYK (0.55) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL13570900 0.92 SYK (0.55) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL13570899 0.92 SYK (0.55) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL9819558 0.92 SYK (0.55) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL22345613 0.91 PPARA (0.52) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL2305361 0.91 PPARA (0.52) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL26894858 0.91 PPARA (0.52) SYKBCHEACHECACNA1FCACNA1D
SCHEMBL21541316 0.91 KYNU (0.54) SYKCTSKCTSLCTSSCTSB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1224186-B1 PYRIDYL-CONTAINING SPIROCYCLIC COMPOUNDS AS INHIBITORS OF FIBRINOGEN-DEPENDENT PLATELET AGGREGATION MILLENNIUM PHARM INC (US) 2003-09-24 EP disclosed
US-20030055244-A1 Pyridyl-containing spirocyclic compounds as inhibitors of fibrinogen-dependent platelet aggregation MILLENNIUM PHARMACEUTICALS, INC. 2003-03-20 US disclosed
US-4485253-A Process for preparing tert-butyl ether or ester containing polyfunctional organic compounds Birr, Christian (DE) 1984-11-27 US 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-20030055244-A1 Pyridyl-containing spirocyclic compounds as inhibitors of fibrinogen-dependent platelet aggregation PF4, PFKP, FGB SYK 58/4885BCHE 4770/4885ACHE 4495/4885

“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.