SCHEMBL25834719

SCHEMBL25834719

CC1=CC(=O)C(c2ccc(Br)cc2)=CC1=O

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 2/20 0.48
PTPRC P08575 1/20 0.47
EEF2K O00418 1/20 0.38
PLK1 P53350 1/20 0.38
PLK2 Q9NYY3 1/20 0.38
ALDH1A1 P00352 4/20 0.37
MAPK1 P28482 3/20 0.36
MEN1 O00255 3/20 0.36
MAPT P10636 3/20 0.36
KMT2A Q03164 3/20 0.36
PKM P14618 2/20 0.36
KDM4E B2RXH2 1/20 0.36
MCL1 Q07820 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
PTGS2 P35354 1/20 0.36
STAT3 P40763 1/20 0.35
GAA P10253 3/20 0.35
HSD17B3 P37058 1/20 0.34
TSHR P16473 1/20 0.33
CYP2A6 P11509 1/20 0.33

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
SCHEMBL14507718 0.77 PLK1 (0.50) BACE1EEF2KPLK1PLK2ALDH1A1
P-Xyloquinone SCHEMBL49964 0.71 PLK1 (0.60) EEF2KPLK1PLK2ALDH1A1MAPK1
SCHEMBL5162553 0.67 EEF2K (0.46) PTPRCEEF2KPLK1PLK2ALDH1A1
SCHEMBL221295 0.64 BACE1 (0.65) BACE1PTPRCALDH1A1MAPTGAA
SCHEMBL6236908 0.64 PTPRC (1.00) BACE1PTPRCPTPN1CDC25B
SCHEMBL22203781 0.62 BACE1 (0.48) BACE1PLK1ALDH1A1MEN1MAPT
SCHEMBL6334698 0.62 PTGS2 (0.47) ALDH1A1MAPK1MEN1MAPTKMT2A
SCHEMBL16656179 0.62 MAPT (0.43) BACE1MAPK1MEN1MAPTKMT2A
SCHEMBL68094 0.61 ALDH1A1 (0.73) ALDH1A1MAPK1MEN1MAPTKMT2A
SCHEMBL1673427 0.61 ALDH1A1 (0.73) ALDH1A1MAPK1MEN1MAPTKMT2A

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
US-20230227393-A1 IRON CATALYZED HIGHLY ENANTIOSELECTIVE CIS-DIHYDROXYLATION OF QUINONES THE UNIVERSITY OF HONG KONG (CN) 2023-07-20 US 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 BACE1 608/4885PTPRC 3535/4885EEF2K 1619/4885

“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.