SCHEMBL25399154

SCHEMBL25399154

C=C(Cc1c(F)cccc1F)C(=O)OCC

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.47
KDM4E B2RXH2 3/20 0.47
MAPT P10636 4/20 0.44
NLRP3 Q96P20 1/20 0.42
CA12 O43570 1/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
CA7 P43166 1/20 0.42
CA9 Q16790 1/20 0.42
CA14 Q9ULX7 1/20 0.42
ALOX15 P16050 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
KMT2A Q03164 5/20 0.41
MEN1 O00255 4/20 0.41
SMN1; SMN2 Q16637 3/20 0.41
TSHR P16473 2/20 0.40
POLB P06746 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
ATM Q13315 1/20 0.40
LMNA P02545 1/20 0.40

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
SCHEMBL7640726 0.83 CTDSP1 (0.53) ALDH1A1KDM4EMAPTNLRP3CA12
SCHEMBL25399370 0.83 ALDH1A1 (0.41) ALDH1A1KDM4EMAPTNLRP3KMT2A
SCHEMBL25397941 0.83 ALDH1A1 (0.48) ALDH1A1KDM4EMAPTKMT2AMEN1
SCHEMBL1867904 0.80 NLRP3 (0.54) ALDH1A1KDM4ENLRP3CA12CA1
SCHEMBL25400177 0.77 MAPT (0.47) ALDH1A1MAPTKMT2AMEN1LMNA
SCHEMBL28094327 0.77 MAPT (0.46) ALDH1A1KDM4EMAPTNLRP3CA12
SCHEMBL18832298 0.77 MAPT (0.40) ALDH1A1MAPTKMT2AMEN1SMN1; SMN2
SCHEMBL8910636 0.75 MAPT (0.51) ALDH1A1KDM4EMAPTTDP1KMT2A
SCHEMBL28832689 0.75 CA12 (0.56) ALDH1A1KDM4EMAPTNLRP3CA12
SCHEMBL21777259 0.75 PTP4A1 (0.36) ALDH1A1KDM4EMAPTALOX15TDP1

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 5 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
CN-116568310-A Boric acid compounds 株式会社LG化学 2023-08-08 CN 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 ALDH1A1 3621/4885KDM4E 3458/4885MAPT 3120/4885
US-20240101579-A1 BORONIC ACID COMPOUNDS PSMB11, PSMB1, BACH1 ALDH1A1 2005/4885KDM4E 2004/4885MAPT 685/4885

“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.