SCHEMBL7205694

SCHEMBL7205694

CC(=O)OC[C@@H](C(C)C)[C@H](O)NC(=O)OC(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ CA1 P00915 2/20 0.46
▸ CA2 P00918 2/20 0.46
▸ CA7 P43166 2/20 0.46
▸ CYP2D6 P10635 1/20 0.46
▸ CTSK P43235 9/20 0.40
▸ CTSS P25774 4/20 0.40
▸ CA4 P22748 1/20 0.39
▸ CA9 Q16790 1/20 0.39
▸ CTSL P07711 4/20 0.38
▸ CTSB P07858 2/20 0.38
▸ KMT2A Q03164 1/20 0.36
▸ PREP P48147 1/20 0.36
▸ CYP1A2 P05177 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ CYP2C19 P33261 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KLK5 Q9Y337 1/20 0.35

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
SCHEMBL20557220 0.79 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
SCHEMBL7353657 0.79 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
SCHEMBL7360111 0.79 CA1 (0.49) CA1CA2CA7CYP2D6CTSK
SCHEMBL12004248 0.79 CYP2D6 (0.64) CA1CA2CA7CYP2D6CTSK
SCHEMBL3057889 0.77 CA1 (0.46) CA1CA2CA7CYP2D6CTSK
SCHEMBL25742657 0.76 CA1 (0.56) CA1CA2CA7CYP2D6CTSK
SCHEMBL13756745 0.76 TDP1 (0.45) —
SCHEMBL1688831 0.74 CTSK (0.46) CA1CA2CA7CYP2D6CTSK
SCHEMBL16020434 0.74 CYP1A2 (0.44) CA1CA2CA7CYP2D6CTSK
Ammonia Solution, Strong SCHEMBL1033679 0.74 TDP1 (0.43) —

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-20030087831-A1 1,3,4-Oxadiazolin-2-one derivatives and drugs containing these derivatives as the active ingredient ONO PHARMACEUTICAL CO., LTD. (JP) 2003-05-08 — — US disclosed
EP-1234834-A1 1,3,4-OXADIAZOLIN-2-ONE DERIVATIVES AND DRUGS CONTAINING THESE DERIVATIVES AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2002-08-28 — — 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-20030087831-A1 1,3,4-Oxadiazolin-2-one derivatives and drugs containing these derivatives as the active ingredient SERPINB1, ELANE, MMP8 CA1 3897/4885CA2 4395/4885CA7 3408/4885

“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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