SCHEMBL4683881

SCHEMBL4683881

CCOP(=O)(OCC)c1ccc(C(NC(=O)OC(C)(C)C)C(=O)OCc2ccccc2)cc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ SYK P43405 1/20 0.47
▸ PPARA Q07869 2/20 0.45
▸ CTSS P25774 3/20 0.45
▸ CTSK P43235 1/20 0.45
▸ LTA4H P09960 1/20 0.45
▸ EPHX2 P34913 1/20 0.45
▸ POLB P06746 1/20 0.42
▸ CTSL P07711 2/20 0.42
▸ BACE1 P56817 2/20 0.42
▸ PPARG P37231 1/20 0.41
▸ NTSR1 P30989 1/20 0.41
▸ KLK7 P49862 2/20 0.41
▸ KLK5 Q9Y337 2/20 0.41
▸ MAPT P10636 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ KLK1 P06870 1/20 0.41
▸ ATM Q13315 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
SCHEMBL2923560 0.88 CTSK (0.43) CTSSCTSKMAPT
SCHEMBL27189418 0.88 PPARA (0.47) SYKPPARACTSSCTSKCTSL
SCHEMBL27189305 0.85 PPARA (0.51) SYKPPARACTSSCTSKCTSL
SCHEMBL2923386 0.85 CTSK (0.46) PPARACTSSCTSKPPARGMAPT
SCHEMBL23837230 0.84 CTSS (0.60) SYKPPARACTSSCTSKPOLB
SCHEMBL17724519 0.84 CTSS (0.60) SYKPPARACTSSCTSKPOLB
SCHEMBL4689229 0.84 CTSS (0.53) SYKPPARACTSSCTSKPOLB
SCHEMBL4689227 0.84 CTSS (0.53) SYKPPARACTSSCTSKPOLB
SCHEMBL9042226 0.84 CTSS (0.53) SYKPPARACTSSCTSKPOLB
SCHEMBL5557488 0.82 CTSS (0.52) SYKPPARACTSSCTSKCTSL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7427635-B2 Substituted hydantoins HOFFMANN-LA ROCHE INC. (US) 2008-09-23 — — US disclosed
EP-1781649-B1 SUBSTITUTED HYDANTOINS HOFFMANN LA ROCHE (CH) 2008-08-13 — — EP disclosed
EP-1781649-A2 SUBSTITUTED HYDANTOINS F. Hoffmann-Roche AG (CH) 2007-05-09 — — EP disclosed
US-20060041146-A1 Substituted hydantoins HOFFMANN-LA ROCHE AG 2006-02-23 — — US disclosed
WO-2006018188-A2 SUBSTITUTED HYDANTOINS F. HOFFMANN-LA ROCHE AG (CH) 2006-02-23 — — WO 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-20060041146-A1 Substituted hydantoins HNMT, MAPK6, KYNU SYK 1057/4885PPARA 3063/4885CTSS 1158/4885

“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.

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