SCHEMBL25399804

SCHEMBL25399804

COC(=O)C1(Cc2ccccc2)CC(CNC(=O)c2cccc(-c3ccccn3)c2)=NO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ HPGDS O60760 5/20 0.41
▸ CTSL P07711 1/20 0.41
▸ CTSB P07858 1/20 0.41
▸ CTSS P25774 1/20 0.41
▸ AURKA O14965 2/20 0.41
▸ PRMT5 O14744 4/20 0.41
▸ WDR77 Q9BQA1 4/20 0.41
▸ KLKB1 P03952 1/20 0.40
▸ CFD P00746 1/20 0.39
▸ KAT6A Q92794 1/20 0.39
▸ JAK2 O60674 1/20 0.38
▸ MAP4K4 O95819 1/20 0.38
▸ CHEK2 O96017 1/20 0.38
▸ PRKCG P05129 1/20 0.38
▸ CDK1 P06493 1/20 0.38
▸ FES P07332 1/20 0.38
▸ RET P07949 1/20 0.38
▸ ROS1 P08922 1/20 0.38
▸ FER P16591 1/20 0.38
▸ FLT1 P17948 1/20 0.38

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
SCHEMBL25398162 0.92 AURKA (0.46) AURKACFDJAK2MAP4K4CHEK2
SCHEMBL29846598 0.89 HPGDS (0.43) HPGDSCTSLCTSBCTSSAURKA
SCHEMBL25401149 0.87 NPC1 (0.47) —
SCHEMBL25397863 0.87 CHRM1 (0.41) MAP4K4PRKCGROCK1PKN2MAP4K5
SCHEMBL25396773 0.85 MMP13 (0.51) AURKA
SCHEMBL25397201 0.85 SMN1; SMN2 (0.47) MAP4K4PRKCGROCK1PKN2MAP4K5
SCHEMBL25397462 0.84 DRD2 (0.44) ROCK1
SCHEMBL25397463 0.84 POLB (0.48) ROCK1
SCHEMBL25400330 0.84 SMN1; SMN2 (0.41) KDM5B
SCHEMBL25398691 0.83 LMNA (0.46) ROCK1

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 HPGDS 4163/4885CTSL 1540/4885CTSB 1170/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 HPGDS 4470/4885CTSL 3794/4885CTSB 842/4885

“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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