SCHEMBL25834369

SCHEMBL25834369

Cc1cccc(C2=CC(=O)[C@H](O)[C@H](C)C2=O)c1

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
DHODH Q02127 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.35
NOTUM Q6P988 1/20 0.34
NISCH Q9Y2I1 1/20 0.34
CYP19A1 P11511 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GLA P06280 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
PTPN5 P54829 1/20 0.33
CA12 O43570 1/20 0.33
CA9 Q16790 1/20 0.33
ACLY P53396 1/20 0.33
SLC5A2 P31639 1/20 0.33
AKR1C3 P42330 1/20 0.33
AKR1C2 P52895 1/20 0.33
CNR1 P21554 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
SCHEMBL25834697 0.88 L3MBTL1 (0.37) DHODHL3MBTL1NOTUMALDH1A1MAPT
SCHEMBL25834371 0.84 MAOB (0.32) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL25834365 0.82 BACE1 (0.38) MEN1KMT2AL3MBTL1ALDH1A1GAA
SCHEMBL25834367 0.81 MAPT (0.33) MEN1KMT2AGAAMAPTHPGD
SCHEMBL25834555 0.80 MCL1 (0.34) NOTUMMAPTCA9
SCHEMBL25834368 0.74 PTPRC (0.34) MEN1KMT2AGAAMAPT
SCHEMBL25834699 0.69 GABRP (0.34) MEN1KMT2AALDH1A1MAPTMAOB
SCHEMBL25837763 0.69 HDAC4 (0.48) MEN1KMT2ANOTUMALDH1A1GAA
SCHEMBL25834786 0.67 CYP2C9 (0.33) MEN1KMT2AALDH1A1GAAMAPT
SCHEMBL1471565 0.66 MAPT (0.46) KMT2AL3MBTL1NOTUMALDH1A1MAPT

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 1 patent. 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

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 MEN1 1455/4885KMT2A 1287/4885DHODH 10/4885

“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.