SCHEMBL4138068

SCHEMBL4138068

CCCCCCCCCCCCCC=Cc1cccc(OC(C)=O)c1

nearest known ligand 0.54

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ PPARA Q07869 5/20 0.47
▸ FAAH O00519 3/20 0.45
▸ PPARG P37231 2/20 0.45
▸ CYP3A4 P08684 1/20 0.44
▸ LMNA P02545 1/20 0.44
▸ EPHX2 P34913 2/20 0.44
▸ BCHE P06276 1/20 0.44
▸ ALOX5 P09917 1/20 0.43
▸ ALOX5AP P20292 1/20 0.43
▸ PTGS1 P23219 1/20 0.43
▸ PTGS2 P35354 1/20 0.43
▸ TLR4 O00206 1/20 0.43
▸ TLR2 O60603 1/20 0.43
▸ CYSLTR2 Q9NS75 1/20 0.43
▸ KDM4E B2RXH2 1/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ SMN1; SMN2 Q16637 1/20 0.43
▸ IMPDH2 P12268 1/20 0.42

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
SCHEMBL28424635 0.89 KDM4E (0.50) CYP3A4LMNABCHEALOX5ALOX5AP
SCHEMBL4147406 0.87 THRB (0.48) PPARAFAAHPPARGEPHX2TLR4
SCHEMBL16167358 0.83 CYP3A4 (0.51) CYP3A4LMNABCHEALOX5ALOX5AP
SCHEMBL16167352 0.83 CYP3A4 (0.51) CYP3A4LMNABCHEALOX5ALOX5AP
SCHEMBL3299520 0.82 RELA (0.53) FAAHEPHX2
Acetic Acid SCHEMBL28383360 0.81 P4HB (0.46) PPARAPPARGKDM4E
SCHEMBL6881641 0.80 BCHE (0.52) CYP3A4LMNABCHEALOX5ALOX5AP
SCHEMBL6881643 0.80 BCHE (0.52) CYP3A4LMNABCHEALOX5ALOX5AP
SCHEMBL10742841 0.79 LCK (0.49) —
SCHEMBL122640 0.79 LCK (0.49) —

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 14 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111056923-B Phenol derivative and preparation method and application thereof 中国石油化工股份有限公司 2023-11-10 — — CN disclosed
CN-113430031-B Lubricating grease and preparation method thereof 中国石油化工股份有限公司 2023-03-10 — — CN disclosed
CN-111088092-B Heavy-load diesel engine oil composition and preparation method thereof 中国石油化工股份有限公司 2022-07-15 — — CN disclosed
CN-111056944-B Phenolic ester compound and preparation method and application thereof 中国石油化工股份有限公司 2022-07-15 — — CN disclosed
CN-111088097-B Vehicle gear oil composition and preparation method thereof 中国石油化工股份有限公司 2022-04-12 — — CN disclosed
CN-111088091-B Gasoline engine oil composition and preparation method thereof 中国石油化工股份有限公司 2022-03-11 — — CN disclosed
CN-113430031-A Lubricating grease and preparation method thereof 中国石油化工股份有限公司 2021-09-24 — — CN disclosed
CN-111088092-A Heavy-duty diesel engine oil composition and preparation method thereof 中国石油化工股份有限公司 2020-05-01 — — CN disclosed
CN-111088097-A Vehicle gear oil composition and preparation method thereof 中国石油化工股份有限公司 2020-05-01 — — CN disclosed
CN-111088091-A Gasoline engine oil composition and preparation method thereof 中国石油化工股份有限公司 2020-05-01 — — CN disclosed
CN-111056923-A Phenol derivative and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 — — CN disclosed
CN-111057041-A Sulfurized phenolic ester derivative and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 — — CN disclosed
CN-111056944-A Phenolic ester compound and preparation method and application thereof 中国石油化工股份有限公司 2020-04-24 — — CN disclosed
US-20090068126-A1 Composition for surface photoprotection SOARES ROMEIRO LUIZ ANTONIO 2009-03-12 — — 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-20090068126-A1 Composition for surface photoprotection S100A10, CD63, S100A9 PPARA 1792/4885FAAH 1449/4885PPARG 2023/4885

“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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