SCHEMBL26212829

SCHEMBL26212829

COc1c(C(C)(C)C)cc(CCC(=O)OCCSCCOC(=O)CCc2cc(C(C)(C)C)c(OC)c(C(C)(C)C)c2)cc1C(C)(C)C

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ALOX5 P09917 1/20 0.41
▸ TDP1 Q9NUW8 1/20 0.39
▸ GAA P10253 3/20 0.38
▸ KMT2A Q03164 4/20 0.38
▸ ALDH1A1 P00352 3/20 0.38
▸ APP P05067 1/20 0.37
▸ VCAM1 P19320 1/20 0.36
▸ NTRK1 P04629 1/20 0.36
▸ MAPT P10636 1/20 0.35

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
SCHEMBL12955280 0.95 GAA (0.46) ALOX5GAAKMT2AVCAM1
SCHEMBL8397561 0.86 ALOX5 (0.43) ALOX5TDP1GAAKMT2AALDH1A1
SCHEMBL30165 0.86 GAA (0.52) ALOX5TDP1GAAKMT2AALDH1A1
Methane SCHEMBL9820093 0.85 GAA (0.51) ALOX5TDP1GAAKMT2AALDH1A1
SCHEMBL18473221 0.85 GAA (0.48) ALOX5GAAKMT2AALDH1A1APP
SCHEMBL7940008 0.84 ALOX5 (0.41) ALOX5TDP1GAAKMT2AALDH1A1
SCHEMBL19103203 0.84 VCAM1 (0.38) ALOX5TDP1GAAKMT2AAPP
SCHEMBL7940661 0.83 VCAM1 (0.41) ALOX5TDP1GAAKMT2AALDH1A1
SCHEMBL7865656 0.83 GAA (0.49) ALOX5TDP1GAAKMT2AALDH1A1
SCHEMBL24809537 0.82 DGKA (0.45) ALOX5GAAKMT2AALDH1A1

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-20230312457-A1 LOW-MIGRATION HINDERED PHENOL ANTIOXIDANT COMPOUND, PREPARATION METHOD AND COMPOSITION TSENG, JERRY (TW) 2023-10-05 — — US disclosed
US-20230272282-A1 LC MIXTURES WITH NEGATIVE DELTA EPSILONCONTAINING CC-4-V1 AND COB(S)-N-OM MERCK PATENT GMBH (DE) 2023-08-31 — — 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-20230312457-A1 LOW-MIGRATION HINDERED PHENOL ANTIOXIDANT COMPOUND, PREPARATION METHOD AND COMPOSITION COMT, CAT, GPX4 ALOX5 89/4885TDP1 4450/4885GAA 1549/4885

“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.

Send feedback