SCHEMBL31211637

SCHEMBL31211637

O=C(O)c1ccnc(C(=O)O)c1C(=O)O.[Ru]

nearest known ligand 0.66

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 13/20 0.66
ASPH Q12797 11/20 0.66
KDM8 Q8N371 11/20 0.66
L3MBTL1 Q9Y468 3/20 0.53
MAPT P10636 3/20 0.53
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 1/20 0.53
ALOX15 P16050 1/20 0.53
TSHR P16473 1/20 0.53
BLM P54132 1/20 0.53
AGER Q15109 1/20 0.53
NPSR1 Q6W5P4 1/20 0.53
TDP1 Q9NUW8 2/20 0.41
KDM4A O75164 2/20 0.41
RAB9A P51151 1/20 0.41
EGLN1 Q9GZT9 1/20 0.41
HIF1AN Q9NWT6 1/20 0.41
CYP1A2 P05177 1/20 0.39
KDM4C Q9H3R0 2/20 0.39
KDM5A P29375 1/20 0.39

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
SCHEMBL547943 0.98 KDM4E (0.68) KDM4EASPHKDM8L3MBTL1MAPT
Hydrochloric Acid SCHEMBL15303932 0.96 KDM4E (0.66) KDM4EASPHKDM8L3MBTL1MAPT
Nitrous Acid SCHEMBL28913579 0.92 KDM4E (0.61) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL14687428 0.84 KDM4E (0.56) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL19857476 0.81 KDM4E (0.52) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL517935 0.79 KDM4E (0.55) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL29525861 0.78 KDM4E (0.53) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL2490882 0.78 KDM4E (0.54) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL28913578 0.78 KDM4E (0.50) KDM4EASPHKDM8L3MBTL1MAPT
SCHEMBL28589292 0.78 KDM4E (0.53) KDM4EASPHKDM8L3MBTL1MAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118976121-A Preparation and application methods of viroid cation-like ruthenium-based nanoparticle 山东第一医科大学附属眼科医院(山东省眼科医院) 2024-11-19 CN claimed
CN-118976121-A Preparation and application methods of viroid cation-like ruthenium-based nanoparticle 山东第一医科大学附属眼科医院(山东省眼科医院) 2024-11-19 CN disclosed
CN-118976121-A Preparation and application methods of viroid cation-like ruthenium-based nanoparticle 山东第一医科大学附属眼科医院(山东省眼科医院) 2024-11-19 CN disclosed