SCHEMBL1278751

SCHEMBL1278751

COc1ccc(/C=C/CO)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 3/20 0.57
LMNA P02545 2/20 0.57
CYP3A4 P08684 2/20 0.57
TP53 P04637 1/20 0.57
TSHR P16473 1/20 0.57
ALDH1A1 P00352 1/20 0.57
GSK3B P49841 1/20 0.56
RELA Q04206 2/20 0.55
TRPA1 O75762 1/20 0.55
CYP1A1 P04798 3/20 0.55
CYP1B1 Q16678 3/20 0.55
PTGS2 P35354 2/20 0.55
F3 P13726 2/20 0.55
ALOX12 P18054 1/20 0.55
PTGS1 P23219 1/20 0.55
CYP1A2 P05177 3/20 0.53
ESR1 P03372 2/20 0.53
NQO2 P16083 2/20 0.53
TUBB4A P04350 2/20 0.53
TUBB P07437 2/20 0.53

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
SCHEMBL1278753 1.00 KDM4E (0.57) KDM4ELMNACYP3A4TP53TSHR
SCHEMBL6964436 0.85 ALDH1A1 (0.50) KDM4ELMNACYP3A4ALDH1A1RELA
SCHEMBL6964447 0.85 ALDH1A1 (0.50) KDM4ELMNACYP3A4ALDH1A1RELA
SCHEMBL4438700 0.84 KDM4E (0.53) KDM4ELMNACYP3A4TP53TSHR
SCHEMBL6266537 0.84 KDM4E (0.53) KDM4ELMNACYP3A4TP53TSHR
Cinnamic Alcohol SCHEMBL28332251 0.83 RAB9A (0.57) KDM4ELMNACYP3A4TP53ALDH1A1
SCHEMBL9276381 0.82 ALDH1A1 (0.62) KDM4ELMNACYP3A4TP53ALDH1A1
SCHEMBL9276383 0.82 ALDH1A1 (0.62) KDM4ELMNACYP3A4TP53ALDH1A1
SCHEMBL12047534 0.81 KDM4E (0.59) KDM4ELMNACYP3A4TP53TSHR
SCHEMBL8647769 0.81 KDM4E (0.59) KDM4ELMNACYP3A4TP53TSHR

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 110 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117142916-A Preparation method of allyl sulfone compound 安徽金桐精细化学有限公司 2023-12-01 CN claimed
CN-113277963-A Amine compound and preparation method and application thereof 南京工业大学 2021-08-20 CN claimed
US-7252845-B2 Synergistic compositions containing aromatic compounds and terpenoids present in Alpinia galanga FERROSAN A/S (DK) 2007-08-07 US claimed
EP-1071440-B1 NOVEL SYNERGISTIC COMPOSITIONS CONTAINING AROMATIC COMPOUNDS AND TERPENOIDS PRESENT IN ALPINIA GALANGA EUROVITA AS (DK) 2007-01-03 EP claimed
US-20030157204-A1 Novel synergistic compositions containing aromatic compounds and terpenoids present in Alpinia galanga ENROVITA A/S 2003-08-21 US claimed
US-6566405-B2 Drugs, cosmetics or dietary supplements; immunomodulation, antiallergens (IgE mediated allergies, e.g., asthma, rhinitis, eczema); anaphylaxis; autoimmune disorders, e.g., Crohn's disease, antiarthritic and ulcer agents; analgesics EUROVITA A/S (DK) 2003-05-20 US claimed
US-20020086906-A1 NOVEL SYNERGISTIC COMPOSITIONS CONTAINING AROMATIC COMPOUNDS AND TERPENOIDS PRESENT IN ALPINIA GALANGA ASTION DEVELOPMENT A/S (DK) 2002-07-04 US claimed
CN-116813449-B Phosphorus coordinated iridium monoatomic catalyst for preparing unsaturated alcohol by selective hydrogenation of alpha, beta-unsaturated aldehyde 中国科学院化学研究所 2024-07-12 CN disclosed
US-20240150269-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS MCMASTER UNIVERSITY (CA) 2024-05-09 US disclosed
CN-117142916-A Preparation method of allyl sulfone compound 安徽金桐精细化学有限公司 2023-12-01 CN disclosed
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds MCMASTER UNIVERSITY (CA) 2023-10-24 US disclosed
CN-116813449-A Phosphorus coordinated iridium monoatomic catalyst for preparing unsaturated alcohol by selective hydrogenation of alpha, beta-unsaturated aldehyde 中国科学院化学研究所 2023-09-29 CN disclosed
CN-114702409-B Method for synthesizing homoallylnitrile compound by using allyl alcohol and acetonitrile 大连理工大学 2023-06-20 CN disclosed
US-4052993-A CINNAMIC DERIVATIVES AS TOBACCO ADDITIVES LIGGETT & MYERS INCORPORATED (US) 1977-10-11 US disclosed
US-4052993-A CINNAMIC DERIVATIVES AS TOBACCO ADDITIVES LIGGETT & MYERS INCORPORATED (US) 1977-10-11 US disclosed
US-4053504-A POLYMERIZATION INHIBITORS SELECTED FROM PHENOLS, AMINES, QUINONES, AND COPPER COMPOUNDS BAYER AKTIENGESELLSCHAFT (DT) 1977-10-11 US disclosed
US-3995054-A MITICIDES ZOECON CORPORATION (US) 1976-11-30 US disclosed
US-3969384-A Esters of cyclopropane alkanoic acids ZOECON CORPORATION (US) 1976-07-13 US disclosed
US-3943943-A Cinnamic derivatives as tobacco additives LIGGETT & MYERS INCORPORATED (US) 1976-03-16 US disclosed
US-3943943-A Cinnamic derivatives as tobacco additives LIGGETT & MYERS INCORPORATED (US) 1976-03-16 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 (2 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-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR KDM4E 2010/4885LMNA 3504/4885CYP3A4 151/4885
US-20240150269-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR KDM4E 2117/4885LMNA 3620/4885CYP3A4 143/4885

“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.