SCHEMBL2045969

SCHEMBL2045969

COc1cccc(O)c1I

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 5/20 0.64
TP53 P04637 2/20 0.64
KDM4E B2RXH2 2/20 0.64
MAPK1 P28482 2/20 0.64
ALDH1A1 P00352 1/20 0.64
LMNA P02545 1/20 0.64
CYP3A4 P08684 1/20 0.64
HPGD P15428 1/20 0.64
ALOX15 P16050 1/20 0.64
ALOX12 P18054 1/20 0.64
HSD17B10 Q99714 1/20 0.64
CA1 P00915 4/20 0.60
CA2 P00918 4/20 0.60
TSHR P16473 1/20 0.60
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
CA12 O43570 3/20 0.46
CA7 P43166 3/20 0.46
CA9 Q16790 3/20 0.46
CA14 Q9ULX7 3/20 0.46

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
SCHEMBL253099 0.83 CA1 (0.58) MAPTTP53KDM4EMAPK1ALDH1A1
SCHEMBL606047 0.79 MAPT (0.43) MAPTTP53KDM4EMAPK1ALDH1A1
3-Methoxycatechol SCHEMBL29477155 0.78 TP53 (1.00) MAPTTP53KDM4EMAPK1ALDH1A1
3-Methoxycatechol SCHEMBL67332 0.78 TP53 (1.00) MAPTTP53KDM4EMAPK1ALDH1A1
SCHEMBL4136425 0.76 CA1 (0.50) MAPTTP53KDM4EMAPK1ALDH1A1
3-Methoxycatechol SCHEMBL11796213 0.76 TP53 (0.95) MAPTTP53KDM4EMAPK1ALDH1A1
SCHEMBL16590519 0.76 CA1 (0.50) MAPTTP53KDM4EMAPK1ALDH1A1
SCHEMBL25874735 0.76 CA1 (0.50) MAPTTP53KDM4EMAPK1ALDH1A1
1,2-Dimethoxybenzene SCHEMBL27631243 0.75 CA2 (0.80) MAPTTP53KDM4EMAPK1ALDH1A1
Guaiacol SCHEMBL29454477 0.75

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 83 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-106831862-B Chiral bridged axial chiral monophosphine ligand and preparation method thereof 中山大学 2021-01-15 CN claimed
CN-106831862-A Axial chirality monophosphorus ligand of one class chirality bridging and preparation method thereof 中山大学 2017-06-13 CN claimed
US-11583527-B2 Hydantoin derivatives useful as Kv3 inhibitors AUTIFONY THERAPEUTICS LIMITED (GB) 2023-02-21 US disclosed
US-11583527-B2 Hydantoin derivatives useful as Kv3 inhibitors AUTIFONY THERAPEUTICS LIMITED (GB) 2023-02-21 US disclosed
US-11541052-B2 Compounds AUTIFONY THERAPEUTICS LIMITED (GB) 2023-01-03 US disclosed
US-11541052-B2 Compounds AUTIFONY THERAPEUTICS LIMITED (GB) 2023-01-03 US disclosed
US-20220054490-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LIMITED (GB) 2022-02-24 US disclosed
US-20220054490-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS AUTIFONY THERAPEUTICS LIMITED (GB) 2022-02-24 US disclosed
US-11197859-B2 Hydantoin derivatives useful as Kv3 inhibitors AUTIFONY THERAPEUTICS LIMITED (GB) 2021-12-14 US disclosed
US-11197859-B2 Hydantoin derivatives useful as Kv3 inhibitors AUTIFONY THERAPEUTICS LIMITED (GB) 2021-12-14 US disclosed
US-20210023084-A1 NOVEL COMPOUNDS AUTIFONY SRL (IT) 2021-01-28 US disclosed
US-20100041555-A1 3-Phenoxy-4-pyridazinol derivatives and herbicidal composition containing the same MITSUI CHEMICALS AGRO, INC. (JP) 2010-02-18 US disclosed
US-7608563-B2 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same MITSUI AGRO CHEMICALS, INC. (JP) 2009-10-27 US disclosed
EP-1426365-B9 3-PHENOXY-4-PYRIDAZINOL DERIVATIVE AND HERBICIDE COMPOSITION CONTAINING THE SAME MITSUI CHEMICALS AGRO INC (JP) 2009-10-21 EP disclosed
EP-1426365-B1 3-PHENOXY-4-PYRIDAZINOL DERIVATIVE AND HERBICIDE COMPOSITION CONTAINING THE SAME SANKYO AGRO CO LTD (JP) 2009-07-15 EP disclosed
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same SANKYO AGRO COMPANY, LIMITED (JP) 2005-02-17 US disclosed
CN-1543455-A 3-phenoxy-4-pyridazinol derivatives and herbicidal compositions containing the same 三共农业株式会社 2004-11-03 CN disclosed
EP-1426365-A1 3-PHENOXY-4-PYRIDAZINOL DERIVATIVE AND HERBICIDE COMPOSITION CONTAINING THE SAME Sankyo Agro Company, Limited (JP) 2004-06-09 EP disclosed
CN-1130365-C Alpha-1 adrenergic compounds, pharmaceutical compositions containing the same and uses thereof ABBOTT CO (US) 2003-12-10 CN disclosed
CN-1246861-A Benzopyranopyrrole and benzopyranopyridine alpha-1 adrenergic compounds ABBOTT LAB (US) 2000-03-08 CN 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 (7 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-11583527-B2 Hydantoin derivatives useful as Kv3 inhibitors KCNN3, KCND3, KCNA3 MAPT 3926/4885TP53 4704/4885KDM4E 1460/4885
US-20220054490-A1 HYDANTOIN DERIVATIVES USEFUL AS KV3 INHIBITORS KCNN3, KCND3, KCNA3 MAPT 3926/4885TP53 4704/4885KDM4E 1460/4885
US-20100041555-A1 3-Phenoxy-4-pyridazinol derivatives and herbicidal composition containing the same CBR3, DDT, CBR1 MAPT 4175/4885TP53 4121/4885KDM4E 923/4885
US-11197859-B2 Hydantoin derivatives useful as Kv3 inhibitors KCNN3, KCND3, KCNA3 MAPT 3926/4885TP53 4704/4885KDM4E 1460/4885
US-20210023084-A1 NOVEL COMPOUNDS KCNN3, KCND3, KCNA3 MAPT 2154/4885TP53 4850/4885KDM4E 2012/4885
US-11541052-B2 Compounds KCNN3, KCNA3, KCNQ3 MAPT 2485/4885TP53 4734/4885KDM4E 1888/4885
US-20050037925-A1 3-phenoxy-4-pyridazinol derivatives and herbicide composition containing the same CBR3, DDT, CHRM2 MAPT 3630/4885TP53 3824/4885KDM4E 960/4885

“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.