SCHEMBL26696282

SCHEMBL26696282

COC(=O)/C=C/C1CCC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 2/20 0.50
NFE2L2 Q16236 2/20 0.50
KEAP1 Q14145 1/20 0.50
CA12 O43570 1/20 0.33
CA1 P00915 1/20 0.33
CA2 P00918 1/20 0.33
TYR P14679 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
CA14 Q9ULX7 1/20 0.33
ALDH1A1 P00352 2/20 0.32
ALOX15 P16050 1/20 0.32
RECQL P46063 1/20 0.32
HSD17B10 Q99714 1/20 0.32
KDM4E B2RXH2 1/20 0.32
MAPT P10636 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
ATP12A P54707 1/20 0.32
TTR P02766 1/20 0.31
APP P05067 1/20 0.31

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
SCHEMBL38250 0.96 HCAR2 (0.50) HCAR2NFE2L2KEAP1CA12CA1
SCHEMBL38251 0.96 HCAR2 (0.50) HCAR2NFE2L2KEAP1CA12CA1
SCHEMBL9064096 0.94 HCAR2 (0.48) HCAR2NFE2L2KEAP1NR1H4
SCHEMBL5608734 0.94 HCAR2 (0.48) HCAR2NFE2L2KEAP1NR1H4
SCHEMBL9129967 0.94 HCAR2 (0.48) HCAR2NFE2L2KEAP1NR1H4
SCHEMBL9129957 0.94 HCAR2 (0.48) HCAR2NFE2L2KEAP1NR1H4
SCHEMBL29263941 0.91 HCAR2 (0.55) HCAR2NFE2L2KEAP1CA12CA1
SCHEMBL1718738 0.91
SCHEMBL1718737 0.91
SCHEMBL19862499 0.84 HCAR2 (0.39) HCAR2NFE2L2KEAP1ATP12A

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-20230339952-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF KUMQUAT BIOSCIENCES INC. 2023-10-26 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-20230339952-A1 MACROCYCLIC HETEROCYCLES AND USES THEREOF HRAS, KRAS, TP53 HCAR2 2762/4885NFE2L2 3154/4885KEAP1 1570/4885

“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.