SCHEMBL29974497

SCHEMBL29974497

O=c1cc(-c2ccc(O)cc2)oc2c(O)c(O)c(O)c(O)c12

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KMT2A Q03164 4/20 1.00
▸ PKM P14618 3/20 1.00
▸ MAPT P10636 3/20 1.00
▸ KDM4E B2RXH2 2/20 1.00
▸ APEX1 P27695 2/20 1.00
▸ TDP1 Q9NUW8 2/20 1.00
▸ INPPL1 O15357 1/20 1.00
▸ ALPL P05186 1/20 1.00
▸ POLB P06746 1/20 1.00
▸ ALPI P09923 1/20 1.00
▸ GAA P10253 1/20 1.00
▸ ALPG P10696 1/20 1.00
▸ RECQL P46063 1/20 1.00
▸ BLM P54132 1/20 1.00
▸ MCL1 Q07820 1/20 1.00
▸ PFKFB3 Q16875 1/20 1.00
▸ L3MBTL1 Q9Y468 1/20 1.00
▸ PPARG P37231 1/20 0.63
▸ CYP1A1 P04798 3/20 0.63
▸ CYP1B1 Q16678 3/20 0.63

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
SCHEMBL14053704 1.00 KMT2A (1.00) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL28104733 0.88 KMT2A (0.78) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL27974348 0.87 MAPT (0.77) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL29974322 0.84 PPARG (0.81) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL27221221 0.84 PPARG (0.81) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL27955350 0.84 PKM (0.72) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL24840880 0.84 KMT2A (0.72) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL476215 0.84 CBS (0.78) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL29435853 0.84 CBS (0.78) KMT2APKMMAPTKDM4EAPEX1
SCHEMBL28986431 0.84 CBS (0.78) KMT2APKMMAPTKDM4EAPEX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4433077-A1 COMPOUNDS FOR TREATING MITOCHONDRIAL DNA DISORDERS UCL Business Ltd (GB) 2024-09-25 — — EP claimed
WO-2023089313-A1 COMPOUNDS FOR TREATING MITOCHONDRIAL DNA DISORDERS UCL BUSINESS LTD (GB) 2023-05-25 — — WO claimed
US-20250017950-A1 COMPOUNDS FOR TREATING MITOCHONDRIAL DNA DISORDERS UCL BUSINESS LTD (GB) 2025-01-16 — — US disclosed
EP-4433077-A1 COMPOUNDS FOR TREATING MITOCHONDRIAL DNA DISORDERS UCL Business Ltd (GB) 2024-09-25 — — EP disclosed
WO-2023089313-A1 COMPOUNDS FOR TREATING MITOCHONDRIAL DNA DISORDERS UCL BUSINESS LTD (GB) 2023-05-25 — — WO disclosed
WO-2022202961-A1 METHOD FOR PRODUCING DEMETHYLATED COMPOUND 株式会社ダイセル 2022-09-29 — — 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-20250017950-A1 COMPOUNDS FOR TREATING MITOCHONDRIAL DNA DISORDERS POLRMT, TK2, GOT2 KMT2A 565/4885PKM 536/4885MAPT 1652/4885

“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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