SCHEMBL8616602

SCHEMBL8616602

[CH2]Oc1ccc(Oc2ccc(Cl)cc2)cc1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOA P21397 2/20 0.58
MAOB P27338 2/20 0.58
LTA4H P09960 8/20 0.42
LMNA P02545 2/20 0.42
CYP2A6 P11509 1/20 0.42
ALDH1A1 P00352 2/20 0.42
KDM4E B2RXH2 1/20 0.42
MEN1 O00255 1/20 0.42
CYP1A2 P05177 1/20 0.42
CYP2D6 P10635 1/20 0.42
MAPT P10636 1/20 0.42
CYP2C9 P11712 1/20 0.42
HPGD P15428 1/20 0.42
CYP2C19 P33261 1/20 0.42
KMT2A Q03164 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
SCN9A Q15858 2/20 0.41
HAO1 Q9UJM8 1/20 0.41
CA2 P00918 1/20 0.40
MMP2 P08253 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
SCHEMBL535486 0.92
SCHEMBL9242729 0.86 MAOA (0.74) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL457634 0.86 MAOA (0.74) MAOAMAOBLTA4HLMNACYP2A6
Formaldehyde SCHEMBL28347928 0.83 MAOA (0.64) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL30385926 0.83 MAOA (0.70) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL3746973 0.83 ALDH1A1 (0.50) MAOAMAOBLMNAALDH1A1KDM4E
SCHEMBL2092129 0.79 MAOA (0.58) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL9121691 0.78 MAOA (0.64) MAOAMAOBLTA4HLMNACYP2A6
SCHEMBL28983374 0.76 LTA4H (0.67) MAOAMAOBLTA4HMEN1KMT2A
SCHEMBL2095654 0.76 LTA4H (0.67) MAOAMAOBLTA4HMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023128696-A1 NOVEL METHOD FOR PREPARING SUBSTITUTED 1-HYDROXY-2-PYRIDONE COMPOUND 주식회사 케이씨아이 2023-07-06 WO claimed
US-20130203822-A1 COMPOUNDS FOR TREATMENT OF TUMORS BEARING DEREGULATED MYC ONCOPROTEINS QUATTRONE ALESSANDRO (IT) 2013-08-08 US claimed
EP-2590648-A2 COMPOUNDS FOR TREATMENT OF TUMORS BEARING DEREGULATED MYC ONCOPROTEINS Quattrone, Alessandro (IT) 2013-05-15 EP claimed
WO-2011161631-A2 COMPOUNDS FOR TREATMENT OF TUMORS BEARING DEREGULATED MYC ONCOPROTEINS QUATTRONE ALESSANDRO (IT) 2011-12-29 WO claimed
US-5817825-A Process for the preparation of 1-hydroxy-2-pyridones HOECHST AKTIENGESELLSCHAFT (DE) 1998-10-06 US claimed
EP-0710650-B1 Process for the preparation of 1-hydroxy-2-pyridones HOECHST AG (DE) 1998-08-26 EP claimed
EP-0710650-A2 Process for the preparation of 1-hydroxy-2-pyridones HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-08 EP claimed
WO-2023128696-A1 NOVEL METHOD FOR PREPARING SUBSTITUTED 1-HYDROXY-2-PYRIDONE COMPOUND 주식회사 케이씨아이 2023-07-06 WO disclosed
US-5817825-A Process for the preparation of 1-hydroxy-2-pyridones HOECHST AKTIENGESELLSCHAFT (DE) 1998-10-06 US disclosed
EP-0710650-B1 Process for the preparation of 1-hydroxy-2-pyridones HOECHST AG (DE) 1998-08-26 EP disclosed
US-5756749-A Process for the preparation of 1-hydroxy-2-pyridones HOECHST AKTIENGESELLSCHAFT (DE) 1998-05-26 US disclosed
CN-1161690-A Substituted pyridines, their use as pesticides and fungicides HOECHST SCHERING AGREVO GMBH (DE) 1997-10-08 CN disclosed
EP-0710650-A2 Process for the preparation of 1-hydroxy-2-pyridones HOECHST AKTIENGESELLSCHAFT (DE) 1996-05-08 EP 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-20130203822-A1 COMPOUNDS FOR TREATMENT OF TUMORS BEARING DEREGULATED MYC ONCOPROTEINS MYC, MYCBP, BCOR MAOA 3409/4885MAOB 2669/4885LTA4H 4677/4885

“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.