SCHEMBL29572464

SCHEMBL29572464

CC(C)=CCC/C(C)=C/CC/C(C)=C/Cc1c(O)c(Cl)c(C)c(C(=O)O)c1O

nearest known ligand 0.71

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ DHODH Q02127 5/20 0.71
▸ APP P05067 3/20 0.64
▸ BACE1 P56817 2/20 0.64
▸ PTPN1 P18031 1/20 0.63
▸ MAOB P27338 2/20 0.62
▸ IMPDH2 P12268 1/20 0.54
▸ PTGES O14684 2/20 0.53
▸ ALOX5 P09917 2/20 0.53
▸ PTGS1 P23219 1/20 0.52
▸ PTGS2 P35354 1/20 0.52
▸ SLC6A3 Q01959 1/20 0.51
▸ TRPM7 Q96QT4 1/20 0.51
▸ DAGLA Q9Y4D2 1/20 0.51
▸ CNR2 P34972 1/20 0.50

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
SCHEMBL15364116 0.99 DHODH (0.69) DHODHAPPBACE1PTPN1MAOB
SCHEMBL15364121 0.99 DHODH (0.69) DHODHAPPBACE1PTPN1MAOB
SCHEMBL15247914 0.91 DHODH (0.60) DHODHAPPBACE1PTPN1MAOB
SCHEMBL2723348 0.90 PTGES (0.61) DHODHAPPBACE1PTPN1MAOB
SCHEMBL19261658 0.87 DHODH (0.56) DHODHAPPBACE1PTPN1MAOB
SCHEMBL15247881 0.85 APP (0.67) DHODHAPPBACE1PTPN1MAOB
SCHEMBL19261676 0.85 DHODH (0.54) DHODHAPPBACE1PTPN1MAOB
SCHEMBL16926180 0.82 PTPN1 (0.52) DHODHAPPBACE1PTPN1MAOB
SCHEMBL15247901 0.82 PTPN1 (0.52) DHODHAPPBACE1PTPN1MAOB
SCHEMBL15374666 0.81 DHODH (0.73) DHODHMAOB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240150269-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS MCMASTER UNIVERSITY (CA) 2024-05-09 — — US disclosed
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds MCMASTER UNIVERSITY (CA) 2023-10-24 — — US disclosed
US-20230113567-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS MCMASTER UNIVERSITY (CA) 2023-04-13 — — US disclosed
EP-4157811-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS McMaster University (CA) 2023-04-05 — — EP disclosed
US-11512034-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds MCMASTER UNIVERSITY (CA) 2022-11-29 — — US disclosed
US-11306317-B2 Method of producing isoprenoids and proteins, genes, and transformants for the same NAGASAKI UNIVERSITY (JP) 2022-04-19 — — 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 (4 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-20230113567-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR DHODH 677/4885APP 1447/4885BACE1 2351/4885
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR DHODH 677/4885APP 1447/4885BACE1 2351/4885
US-11512034-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR DHODH 677/4885APP 1447/4885BACE1 2351/4885
US-20240150269-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR DHODH 776/4885APP 1679/4885BACE1 1851/4885

“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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