SCHEMBL20314797

SCHEMBL20314797

CCC(=O)N[C@@H](CC)B(O)O

nearest known ligand 0.53

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ PSMB5 P28074 10/20 0.53
▸ CYP2C9 P11712 1/20 0.45
▸ DPP7 Q9UHL4 6/20 0.41
▸ DPP8 Q6V1X1 5/20 0.41
▸ DPP4 P27487 5/20 0.41
▸ DPP9 Q86TI2 5/20 0.41
▸ PSMB8 P28062 2/20 0.38
▸ PSMB1 P20618 1/20 0.36

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
SCHEMBL25682244 0.81 PSMB5 (0.49) PSMB5CYP2C9DPP7DPP8DPP4
SCHEMBL25682249 0.79 PSMB5 (0.47) PSMB5CYP2C9DPP7DPP8DPP4
SCHEMBL15060447 0.74 DPP4 (0.50) PSMB5CYP2C9DPP7DPP8DPP4
SCHEMBL11892766 0.70 LMNA (0.53) CYP2C9
SCHEMBL9917049 0.69 CYP2C9 (0.50) PSMB5CYP2C9
SCHEMBL4863908 0.69 — —
SCHEMBL7604693 0.69 — —
SCHEMBL875553 0.69 — —
SCHEMBL10053615 0.67 DPP7 (0.43) PSMB5DPP7DPP8DPP4DPP9
SCHEMBL155431 0.67 — —

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180179232-A1 BORONIC ACID DERIVATIVES MERCK PATENT GMBH (DE) 2018-06-28 — — 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-20180179232-A1 BORONIC ACID DERIVATIVES BCL9, BCL9L, BCL6 PSMB5 105/4885CYP2C9 4374/4885DPP7 187/4885

“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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