SCHEMBL8539124

SCHEMBL8539124

COC(=O)c1cc(O)c(O)c(Br)c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
XDH P47989 2/20 0.74
KDM4E B2RXH2 1/20 0.74
LMNA P02545 1/20 0.74
POLB P06746 1/20 0.74
GAA P10253 1/20 0.74
NFKB1 P19838 1/20 0.74
GFER P55789 1/20 0.74
NFKB2 Q00653 1/20 0.74
RELA Q04206 1/20 0.74
FUT7 Q11130 1/20 0.74
TDP1 Q9NUW8 1/20 0.74
L3MBTL1 Q9Y468 1/20 0.74
PTPN1 P18031 3/20 0.57
PTPN11 Q06124 3/20 0.57
PTPN2 P17706 1/20 0.57
CA12 O43570 2/20 0.53
CA1 P00915 2/20 0.53
CA2 P00918 2/20 0.53
CA7 P43166 2/20 0.53
CA9 Q16790 2/20 0.53

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
SCHEMBL282481 0.90 KDM4E (0.63) XDHKDM4ELMNAPOLBGAA
Gallic Acid Methyl Ester SCHEMBL39513 0.86 KDM4E (1.00) XDHKDM4ELMNAPOLBGAA
SCHEMBL29742519 0.85 POLB (0.58) XDHKDM4ELMNAPOLBGAA
SCHEMBL400542 0.85 POLB (0.58) XDHKDM4ELMNAPOLBGAA
Gallic Acid Methyl Ester SCHEMBL28507408 0.84 KDM4E (0.95) XDHKDM4ELMNAPOLBGAA
Gallic Acid Methyl Ester SCHEMBL21543905 0.84 KDM4E (0.95) XDHKDM4ELMNAPOLBGAA
Gallic Acid Methyl Ester SCHEMBL21611341 0.84 KDM4E (0.95) XDHKDM4ELMNAPOLBGAA
Gallic Acid Methyl Ester SCHEMBL28556619 0.84 KDM4E (0.95) XDHKDM4ELMNAPOLBGAA
SCHEMBL14466473 0.83 KDM4E (0.55) XDHKDM4ELMNAPOLBGAA
SCHEMBL402038 0.83 KDM4E (0.55) XDHKDM4ELMNAPOLBGAA

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 12 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250122212-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2025-04-17 US disclosed
WO-2025078808-A1 NOVEL COMPOUNDS SITRYX THERAPEUTICS LIMITED (GB) 2025-04-17 WO disclosed
CN-116947856-A EZH2 inhibitor and preparation method and application thereof 星希尔生物科技(上海)有限公司 2023-10-27 CN disclosed
EP-0584085-B1 ANTIBIOTIC CARBAPENEM DERIVATIVES ZENECA LTD (GB) 1998-09-09 EP disclosed
US-5554606-A THIENAMYCIN DERIVATIVES; PSEUDOMONAS ZENECA LIMITED (GB) 1996-09-10 US disclosed
US-5447925-A Carbapenems with side-chain S; use to treat infections IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1995-09-05 US disclosed
US-5438052-A Cephalosporin derivatives HOFFMANN-LA ROCHE INC. (US) 1995-08-01 US disclosed
EP-0584085-A1 ANTIBIOTIC CARBAPENEM DERIVATIVES ZENECA LIMITED (GB) 1994-03-02 EP disclosed
EP-0580632-A1 ANTIBIOTIC CARBAPENEM DERIVATIVES ZENECA LIMITED (GB) 1994-02-02 EP disclosed
EP-0544166-A2 Cephalosporinderivatives F. HOFFMANN-LA ROCHE AG (CH) 1993-06-02 EP disclosed
WO-1992017480-A1 ANTIBIOTIC CARBAPENEM DERIVATIVES ZENECA LTD. (GB) 1992-10-15 WO disclosed
WO-1992017479-A1 ANTIBIOTIC CARBAPENEM DERIVATIVES ZENECA LTD. (GB) 1992-10-15 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 (1 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-20250122212-A1 NOVEL COMPOUNDS CYP11B1, CYP11B2, UGT1A1 XDH 1052/4885KDM4E 3515/4885LMNA 3312/4885

“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.