SCHEMBL23823741

SCHEMBL23823741

COC(=O)/C=C/C(=O)C(=O)N1CCN(C(=O)OC(C)(C)C)CC1

nearest known ligand 0.45

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ USP2 O75604 1/20 0.45
▸ SMN1; SMN2 Q16637 1/20 0.45
▸ EPHX2 P34913 1/20 0.42
▸ ALDH1A1 P00352 1/20 0.41
▸ EPHX1 P07099 1/20 0.40
▸ KEAP1 Q14145 1/20 0.39
▸ NFE2L2 Q16236 1/20 0.39
▸ HCAR2 Q8TDS4 1/20 0.39
▸ NR1H2 P55055 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ TGM2 P21980 4/20 0.39
▸ F13A1 P00488 2/20 0.39
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ TGM1 P22735 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
SCHEMBL2193042 0.84 ALDH1A1 (0.51) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL2193039 0.84 ALDH1A1 (0.51) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL23823914 0.77 HCAR2 (0.48) SMN1; SMN2ALDH1A1KEAP1NFE2L2HCAR2
SCHEMBL30418583 0.77 USP2 (0.43) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL16090965 0.76 ALDH1A1 (0.40) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL334091 0.76 USP2 (0.60) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL698803 0.76 USP2 (0.69) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL18294 0.76 USP2 (0.69) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL743795 0.75 EPHX1 (0.49) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1
SCHEMBL743796 0.75 EPHX1 (0.49) USP2SMN1; SMN2EPHX2ALDH1A1EPHX1

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-20230139593-A1 TREATMENT OF DISORDERS ASSOCIATED WITH OXIDATIVE STRESS AND COMPOUNDS FOR SAME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-05-04 — — US disclosed
WO-2021179049-A1 TREATMENT OF DISORDERS ASSOCIATED WITH OXIDATIVE STRESS AND COMPOUNDS FOR SAME THE UNIVERSITY OF ADELAIDE (AU) 2021-09-16 — — WO 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-20230139593-A1 TREATMENT OF DISORDERS ASSOCIATED WITH OXIDATIVE STRESS AND COMPOUNDS FOR SAME GPX4, TXNRD2, TXN2 USP2 3684/4885SMN1; SMN2 173/4885EPHX2 1061/4885

“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.

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