SCHEMBL25401415

SCHEMBL25401415

COC(=O)C1(Cc2ccccc2)CC(CNC(=O)c2cccn3cc(C)nc23)=NO1

nearest known ligand 0.38

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 1/20 0.38
▸ KDM4E B2RXH2 2/20 0.37
▸ MAPK1 P28482 1/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ HTR4 Q13639 8/20 0.35
▸ ROCK2 O75116 1/20 0.35
▸ PIM1 P11309 1/20 0.35
▸ USP2 O75604 1/20 0.35
▸ TSHR P16473 1/20 0.35
▸ ESR1 P03372 1/20 0.34
▸ MAPT P10636 1/20 0.34
▸ MAPK10 P53779 1/20 0.34
▸ KMT2A Q03164 1/20 0.34
▸ TP53 P04637 1/20 0.34
▸ GLA P06280 1/20 0.34
▸ HSD17B10 Q99714 1/20 0.34
▸ APOBEC3A P31941 1/20 0.33

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
SCHEMBL25400630 0.86 MAPT (0.36) KDM4EALDH1A1HPGDMAPTKMT2A
SCHEMBL25400612 0.86 HPGD (0.34) KDM4EALDH1A1HPGDESR1MAPT
SCHEMBL25399421 0.84 KMT2A (0.37) KDM4EALDH1A1HPGDHTR4ESR1
SCHEMBL25397353 0.83 PSMB5 (0.36) IRAK4MAPK1HTR4
SCHEMBL25398479 0.81 GAA (0.41) KDM4EALDH1A1HPGDUSP2KMT2A
SCHEMBL25400863 0.81 HPGD (0.43) ALDH1A1HPGDESR1MAPTMAPK10
SCHEMBL25400616 0.80 NPC1 (0.43) ALDH1A1HPGDTP53GLA
SCHEMBL25399567 0.80 TAS1R3 (0.38) MAPK1HPGDESR1MAPTMAPK10
SCHEMBL25396543 0.80 CHRNB2 (0.51) MAPK1ALDH1A1HPGDKMT2ATP53
SCHEMBL29846451 0.80 CHRNB2 (0.51) MAPK1ALDH1A1HPGDKMT2ATP53

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 IRAK4 2688/4885KDM4E 3458/4885MAPK1 815/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 IRAK4 1276/4885KDM4E 2004/4885MAPK1 152/4885

“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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