SCHEMBL25398162

SCHEMBL25398162

COC(=O)C1(Cc2ccccc2)CC(CNC(=O)c2cccc(-c3ccccc3)c2)=NO1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 3/20 0.46
▸ EPHX2 P34913 1/20 0.46
▸ NR1H4 Q96RI1 1/20 0.46
▸ CFD P00746 1/20 0.45
▸ ERN1 O75460 2/20 0.43
▸ SENP1 Q9P0U3 5/20 0.42
▸ SMN1; SMN2 Q16637 2/20 0.41
▸ KDM4E B2RXH2 1/20 0.41
▸ ALDH1A1 P00352 1/20 0.41
▸ HPGD P15428 1/20 0.41
▸ ROCK1 Q13464 2/20 0.41
▸ JAK2 O60674 1/20 0.41
▸ MAP4K4 O95819 1/20 0.41
▸ CHEK2 O96017 1/20 0.41
▸ PRKCG P05129 1/20 0.41
▸ CDK1 P06493 1/20 0.41
▸ FES P07332 1/20 0.41
▸ RET P07949 1/20 0.41
▸ ROS1 P08922 1/20 0.41
▸ FER P16591 1/20 0.41

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
SCHEMBL25399804 0.92 HPGDS (0.41) AURKAEPHX2NR1H4CFDERN1
SCHEMBL25401149 0.91 NPC1 (0.47) SMN1; SMN2ALDH1A1HPGD
SCHEMBL25397201 0.91 SMN1; SMN2 (0.47) EPHX2NR1H4SMN1; SMN2HPGDROCK1
SCHEMBL25397863 0.91 CHRM1 (0.41) SMN1; SMN2ALDH1A1HPGDROCK1MAP4K4
SCHEMBL25396773 0.90 MMP13 (0.51) AURKASMN1; SMN2ALDH1A1HPGD
SCHEMBL25397463 0.88 POLB (0.48) SMN1; SMN2KDM4EALDH1A1ROCK1ROCK2
SCHEMBL25397462 0.88 DRD2 (0.44) ALDH1A1ROCK1ROCK2
SCHEMBL25399827 0.87 ALDH1A1 (0.46) EPHX2SENP1KDM4EALDH1A1HPGD
SCHEMBL25398691 0.87 LMNA (0.46) ALDH1A1ROCK1ROCK2
SCHEMBL29846829 0.87 ALDH1A1 (0.46) EPHX2SENP1KDM4EALDH1A1HPGD

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 AURKA 3319/4885EPHX2 1735/4885NR1H4 414/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 AURKA 2841/4885EPHX2 3926/4885NR1H4 607/4885

“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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