SCHEMBL25399638

SCHEMBL25399638

CCOC(=O)C1CC(CNC(=O)C2Cc3ccccc3C2)=NO1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ TP53 P04637 2/20 0.41
▸ LMNA P02545 6/20 0.41
▸ TSHR P16473 3/20 0.41
▸ MEN1 O00255 2/20 0.41
▸ KMT2A Q03164 2/20 0.41
▸ TDP1 Q9NUW8 1/20 0.41
▸ L3MBTL1 Q9Y468 1/20 0.41
▸ EPHX2 P34913 1/20 0.38
▸ HPGD P15428 3/20 0.38
▸ HTT P42858 2/20 0.38
▸ CYP1A2 P05177 2/20 0.38
▸ CYP2D6 P10635 2/20 0.38
▸ CA1 P00915 1/20 0.38
▸ CA2 P00918 1/20 0.38
▸ ALDH1A1 P00352 4/20 0.38
▸ RAB9A P51151 1/20 0.38
▸ NPSR1 Q6W5P4 1/20 0.38
▸ HSD17B10 Q99714 1/20 0.38
▸ NR1D1 P20393 1/20 0.37
▸ CYP3A4 P08684 1/20 0.37

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
SCHEMBL25402422 0.82 MEN1 (0.46) LMNATSHRMEN1KMT2AEPHX2
SCHEMBL25398711 0.81 KMT2A (0.46) LMNATSHRMEN1KMT2ATDP1
SCHEMBL25399160 0.78 HPGD (0.43) LMNATSHRMEN1KMT2AL3MBTL1
SCHEMBL25399750 0.78 HPGD (0.49) TP53TSHRTDP1HPGDALDH1A1
SCHEMBL25402693 0.77 HPGD (0.45) MEN1KMT2AHPGDALDH1A1NR1D1
SCHEMBL25400119 0.77 P2RY12 (0.51) TP53LMNATSHRKMT2AHPGD
SCHEMBL25400299 0.77 NR1D1 (0.48) LMNAMEN1KMT2ATDP1L3MBTL1
SCHEMBL25399266 0.75 ALDH1A1 (0.44) TP53LMNATSHRMEN1KMT2A
SCHEMBL24517975 0.75 TSHR (0.43) LMNATSHRMEN1KMT2ATDP1
SCHEMBL29846648 0.74 RAB9A (0.46) LMNATSHRMEN1KMT2ACYP1A2

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 TP53 1120/4885LMNA 151/4885TSHR 1670/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 TP53 545/4885LMNA 1548/4885TSHR 4034/4885

“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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