SCHEMBL20497366

SCHEMBL20497366

COC(=O)C=CC(=O)OC1CC1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HCAR2 Q8TDS4 3/20 0.59
NFE2L2 Q16236 2/20 0.59
KEAP1 Q14145 1/20 0.59
ALDH1A1 P00352 3/20 0.36
MAPT P10636 2/20 0.36
KDM4E B2RXH2 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
ABCB1 P08183 1/20 0.36
EPHX1 P07099 2/20 0.34
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
TYR P14679 1/20 0.34
CA7 P43166 1/20 0.34
CA9 Q16790 1/20 0.34
CA14 Q9ULX7 1/20 0.34
ATM Q13315 1/20 0.34
GFPT1 Q06210 1/20 0.34
HTT P42858 2/20 0.34
ALOX15 P16050 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
SCHEMBL9245002 1.00 HCAR2 (0.59) HCAR2NFE2L2KEAP1ALDH1A1MAPT
SCHEMBL31190394 0.92 HCAR2 (0.50) HCAR2NFE2L2KEAP1ALDH1A1MAPT
SCHEMBL1088218 0.91 HCAR2 (0.54) HCAR2NFE2L2KEAP1ALDH1A1MAPT
SCHEMBL1088172 0.91 HCAR2 (0.54) HCAR2NFE2L2KEAP1ALDH1A1MAPT
SCHEMBL1088175 0.91 HCAR2 (0.54) HCAR2NFE2L2KEAP1ALDH1A1MAPT
SCHEMBL10712879 0.90 HCAR2 (0.52) HCAR2NFE2L2KEAP1EPHX1CA12
SCHEMBL10712880 0.90 HCAR2 (0.52) HCAR2NFE2L2KEAP1EPHX1CA12
SCHEMBL9246773 0.90 HCAR2 (0.52) HCAR2NFE2L2KEAP1EPHX1CA12
SCHEMBL9241943 0.90 HCAR2 (0.52) HCAR2NFE2L2KEAP1EPHX1CA12
SCHEMBL2884283 0.88 ATM (0.39) HCAR2NFE2L2KEAP1ABCB1EPHX1

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-20180265527-A1 Acyl Germanium Photoinitiators And Process For The Preparation Thereof IVOCLAR VIVADENT AG (LI) 2018-09-20 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-20180265527-A1 Acyl Germanium Photoinitiators And Process For The Preparation Thereof AGPAT5, AGPAT2, GLRA2 HCAR2 1714/4885NFE2L2 767/4885KEAP1 1641/4885

“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.