SCHEMBL25401463

SCHEMBL25401463

CC(C)C[C@H](NC(=O)C1CC(c2ccc3ccccc3c2)=NO1)B(O)O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ NPSR1 Q6W5P4 1/20 0.50
▸ POLB P06746 1/20 0.49
▸ F10 P00742 1/20 0.49
▸ CYP1A2 P05177 2/20 0.48
▸ CYP2C19 P33261 2/20 0.48
▸ NPC1 O15118 1/20 0.47
▸ HPGD P15428 1/20 0.47
▸ RAB9A P51151 1/20 0.47
▸ LMNA P02545 2/20 0.43
▸ TSHR P16473 2/20 0.43
▸ CYP3A4 P08684 1/20 0.43
▸ CYP2D6 P10635 1/20 0.43
▸ MEN1 O00255 1/20 0.43
▸ KMT2A Q03164 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ L3MBTL1 Q9Y468 1/20 0.43
▸ CA1 P00915 4/20 0.43
▸ CA2 P00918 4/20 0.43
▸ PSMB5 P28074 2/20 0.42
▸ PSMB8 P28062 1/20 0.42

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
SCHEMBL25401468 1.00 NPSR1 (0.50) NPSR1POLBF10CYP1A2CYP2C19
SCHEMBL25399326 0.88 NPSR1 (0.44) NPSR1POLBCYP1A2CYP2C19NPC1
SCHEMBL29846715 0.88 NPSR1 (0.44) NPSR1POLBCYP1A2CYP2C19NPC1
SCHEMBL25399319 0.88 NPSR1 (0.44) NPSR1POLBCYP1A2CYP2C19NPC1
SCHEMBL25401688 0.88 CA1 (0.55) NPSR1POLBF10CYP1A2CYP2C19
SCHEMBL25401694 0.88 CA1 (0.55) NPSR1POLBF10CYP1A2CYP2C19
SCHEMBL25399140 0.88 CA1 (0.57) NPSR1POLBCYP1A2CYP2C19NPC1
SCHEMBL25399144 0.88 CA1 (0.57) NPSR1POLBCYP1A2CYP2C19NPC1
SCHEMBL25399609 0.87 NPSR1 (0.53) NPSR1POLBCYP1A2CYP2C19NPC1
SCHEMBL25399613 0.87 NPSR1 (0.53) NPSR1POLBCYP1A2CYP2C19NPC1

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-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
CN-116568310-A Boric acid compounds 株式会社LG化学 2023-08-08 — — CN 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 2598/4885POLB 2583/4885F10 3277/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 NPSR1 4263/4885POLB 2634/4885F10 4464/4885

“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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