SCHEMBL25834318

SCHEMBL25834318

Cc1cccc(C2=CC(=O)C=CC2=O)c1

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.60
MAOA P21397 1/20 0.60
HSD17B3 P37058 1/20 0.56
KDM4E B2RXH2 2/20 0.49
MAPT P10636 2/20 0.49
MAPK1 P28482 2/20 0.49
TDP1 Q9NUW8 2/20 0.49
MEN1 O00255 1/20 0.49
PKM P14618 1/20 0.49
KMT2A Q03164 1/20 0.49
MCL1 Q07820 1/20 0.49
SETD7 Q8WTS6 2/20 0.42
CCR6 P51684 1/20 0.41
HKDC1 Q2TB90 1/20 0.41
ACHE P22303 1/20 0.39
NOTUM Q6P988 1/20 0.39
PTPN11 Q06124 1/20 0.39
HSP90AA1 P07900 1/20 0.38
MGLL Q99685 1/20 0.38
CHRNB4 P30926 1/20 0.38

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
SCHEMBL6331662 0.80 MAOA (0.52) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL28028117 0.79 HSD17B3 (0.75) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL25835140 0.79 KDM4E (0.64) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL25834314 0.78 MAOB (0.66) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL3767108 0.78 MAOA (0.60) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL3786541 0.76 KDM4E (0.66) MAOBMAOAHSD17B3KDM4EMAPT
Ethane SCHEMBL28553030 0.76 MAOA (0.91) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL26262 0.76 MAOA (1.00) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL29694584 0.76 MCL1 (0.55) MAOBMAOAHSD17B3KDM4EMAPT
SCHEMBL27485672 0.76 MCL1 (0.55) MAOBMAOAHSD17B3KDM4EMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118325078-A Preparation method and application of benzoquinone conjugated polymer 中国科学院宁波材料技术与工程研究所 2024-07-12 CN disclosed
US-20230227393-A1 IRON CATALYZED HIGHLY ENANTIOSELECTIVE CIS-DIHYDROXYLATION OF QUINONES THE UNIVERSITY OF HONG KONG (CN) 2023-07-20 US 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-20230227393-A1 IRON CATALYZED HIGHLY ENANTIOSELECTIVE CIS-DIHYDROXYLATION OF QUINONES NFE2L2, DUOX1, DUOX2 MAOB 90/4885MAOA 44/4885HSD17B3 124/4885

“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.