SCHEMBL25399567

SCHEMBL25399567

COC(=O)C1(Cc2ccccc2)CC(CNC(=O)c2conc2C)=NO1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TAS1R3 Q7RTX0 4/20 0.38
▸ TAS1R1 Q7RTX1 4/20 0.38
▸ TAS1R2 Q8TE23 4/20 0.38
▸ AKR1C3 P42330 6/20 0.36
▸ GAA P10253 1/20 0.36
▸ TP53 P04637 1/20 0.35
▸ GLA P06280 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ MAPT P10636 2/20 0.35
▸ CYP2C19 P33261 2/20 0.35
▸ CYP3A4 P08684 1/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ KMT2A Q03164 2/20 0.35
▸ MEN1 O00255 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ HTT P42858 1/20 0.34
▸ CYP1A2 P05177 1/20 0.34
▸ CYP2D6 P10635 1/20 0.34
▸ ESR1 P03372 1/20 0.34
▸ MAPK10 P53779 1/20 0.34

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
SCHEMBL29846843 0.90 TAS1R3 (0.39) TAS1R3TAS1R1TAS1R2AKR1C3GAA
SCHEMBL25398479 0.84 GAA (0.41) AKR1C3GAATP53GLAHPGD
SCHEMBL25397863 0.84 CHRM1 (0.41) TP53HPGDMAPK1
SCHEMBL25400616 0.83 NPC1 (0.43) TP53GLAHPGDCYP1A2
SCHEMBL29846451 0.83 CHRNB2 (0.51) TAS1R3TAS1R1GAATP53GLA
SCHEMBL25396543 0.83 CHRNB2 (0.51) TAS1R3TAS1R1GAATP53GLA
SCHEMBL25400794 0.82 CYP1A2 (0.57) HPGDMAPTCYP2C19KMT2AMEN1
SCHEMBL25400863 0.82 HPGD (0.43) TP53GLAHPGDMAPTKMT2A
SCHEMBL25397589 0.81 HTT (0.40) GAATP53GLAHPGDMAPT
SCHEMBL25401482 0.81 KLKB1 (0.40) HPGDMAPTCYP2C19CYP3A4CYP2C9

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 TAS1R3 4302/4885TAS1R1 3861/4885TAS1R2 4354/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 TAS1R3 4080/4885TAS1R1 2861/4885TAS1R2 4072/4885

“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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