SCHEMBL25399414

SCHEMBL25399414

CC(C)C[C@H](NC(=O)C1CC([C@H](CC(C)C)NC(=O)c2nccc3ccccc23)=NO1)B(O)O

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCR1 P32246 1/20 0.42
▸ PSMB5 P28074 16/20 0.39
▸ PSMB1 P20618 5/20 0.39
▸ CASP1 P29466 1/20 0.36
▸ CASP3 P42574 1/20 0.36
▸ CASP7 P55210 1/20 0.36
▸ LONP1 P36776 4/20 0.36
▸ PSMB11 A5LHX3 3/20 0.36
▸ PSMA7 O14818 3/20 0.36
▸ PSMA1 P25786 3/20 0.36
▸ PSMA2 P25787 3/20 0.36
▸ PSMA3 P25788 3/20 0.36
▸ PSMA4 P25789 3/20 0.36
▸ PSMB8 P28062 3/20 0.36
▸ PSMB9 P28065 3/20 0.36
▸ PSMA5 P28066 3/20 0.36
▸ PSMB4 P28070 3/20 0.36
▸ PSMB6 P28072 3/20 0.36
▸ PSMB10 P40306 3/20 0.36
▸ PSMB3 P49720 3/20 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
SCHEMBL25399419 1.00 CCR1 (0.42) CCR1PSMB5PSMB1CASP1CASP3
SCHEMBL25398921 0.92 CCR1 (0.42) CCR1PSMB5PSMB1CASP1CASP3
SCHEMBL25398919 0.92 CCR1 (0.42) CCR1PSMB5PSMB1CASP1CASP3
SCHEMBL25400340 0.85 CCR1 (0.41) CCR1PSMB5PSMB1CASP1CASP3
SCHEMBL25400333 0.85 CCR1 (0.41) CCR1PSMB5PSMB1CASP1CASP3
SCHEMBL25396619 0.83 PSMB5 (0.51) PSMB5PSMB1PSMB8PSMB9PSMB2
SCHEMBL25396612 0.83 PSMB5 (0.51) PSMB5PSMB1PSMB8PSMB9PSMB2
SCHEMBL25399587 0.83 CCR1 (0.42) CCR1CASP1CASP3CASP7HDAC3
SCHEMBL25399591 0.83 CCR1 (0.42) CCR1CASP1CASP3CASP7HDAC3
SCHEMBL25397955 0.81 PSMB5 (0.42) PSMB5PSMB1CASP1CASP3CASP7

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
US-12570675-B2 Boronic acid compounds LG CHEM, LTD. (KR) 2026-03-10 — — US disclosed
US-20240101579-A1 BORONIC ACID COMPOUNDS LG CHEM, LTD. (KR) 2024-03-28 — — US disclosed
EP-4242213-A1 BORONIC ACID COMPOUND Lg Chem, Ltd. (KR) 2023-09-13 — — 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 (2 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-12570675-B2 Boronic acid compounds PSMB6, PSMB3, PSMB2 CCR1 297/4885PSMB5 10/4885PSMB1 4/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 CCR1 2541/4885PSMB5 7/4885PSMB1 2/4885

“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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