SCHEMBL25399167

SCHEMBL25399167

CC(C)C[C@H](NC(=O)C1CC(c2cc3ccccc3cn2)=NO1)B(O)O

nearest known ligand 0.42

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.42
▸ PSMB5 P28074 12/20 0.41
▸ PSMB8 P28062 4/20 0.41
▸ POLB P06746 1/20 0.41
▸ CYP1A2 P05177 1/20 0.41
▸ CYP2C19 P33261 1/20 0.41
▸ NPC1 O15118 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ RAB9A P51151 1/20 0.39
▸ PSMB9 P28065 3/20 0.39
▸ CA1 P00915 4/20 0.38
▸ CA2 P00918 4/20 0.38
▸ PSMB1 P20618 2/20 0.37
▸ PSMB2 P49721 1/20 0.37

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
SCHEMBL25399173 1.00 NPSR1 (0.42) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25401468 0.85 NPSR1 (0.50) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25401463 0.85 NPSR1 (0.50) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25399374 0.84 POLB (0.39) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25399372 0.84 POLB (0.39) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25400492 0.83 NPSR1 (0.43) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL29846653 0.83 NPSR1 (0.43) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25400488 0.83 NPSR1 (0.43) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL29846176 0.82 CA1 (0.46) NPSR1PSMB5PSMB8POLBCYP1A2
SCHEMBL25397422 0.82 PSMB5 (0.52) NPSR1PSMB5PSMB8POLBCYP1A2

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 4 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
WO-2022123530-A1 BORONIC ACID COMPOUND 주식회사 엘지화학 2022-06-16 — — 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 (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 NPSR1 2598/4885PSMB5 10/4885PSMB8 5/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 NPSR1 4263/4885PSMB5 7/4885PSMB8 28/4885

“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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