SCHEMBL24074936

SCHEMBL24074936

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

nearest known ligand 0.60

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ PTGES O14684 2/20 0.60
▸ ALOX5 P09917 2/20 0.60
▸ PTGS1 P23219 1/20 0.56
▸ PTGS2 P35354 1/20 0.56
▸ APP P05067 4/20 0.52
▸ BACE1 P56817 3/20 0.52
▸ PTPN1 P18031 2/20 0.52
▸ SLC6A3 Q01959 1/20 0.49
▸ TRPM7 Q96QT4 1/20 0.49
▸ DAGLA Q9Y4D2 1/20 0.49
▸ CNR2 P34972 1/20 0.48
▸ MAOB P27338 3/20 0.48
▸ OSBP P22059 1/20 0.47
▸ CTSL P07711 1/20 0.46
▸ MGAM O43451 1/20 0.46

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
SCHEMBL24075655 0.88 MEN1 (0.49) PTGESALOX5PTGS1PTGS2MAOB
SCHEMBL24074938 0.88 PTGES (0.57) PTGESALOX5PTGS1PTGS2APP
SCHEMBL31580515 0.85 MEN1 (0.49) PTGESALOX5PTGS1PTGS2MAOB
SCHEMBL24075568 0.84 ALOX5 (0.77) PTGESALOX5PTGS1PTGS2APP
SCHEMBL29377594 0.79 FASN (0.46) PTGESALOX5PTGS1PTGS2APP
SCHEMBL24074934 0.77 PTGES (0.60) PTGESALOX5PTGS1PTGS2APP
SCHEMBL24075656 0.75 HIF1A (0.56) PTGESALOX5MAOB
SCHEMBL24075662 0.74 PTGES (0.72) PTGESALOX5PTGS1PTGS2APP
SCHEMBL2723348 0.73 PTGES (0.61) PTGESALOX5PTGS1PTGS2APP
SCHEMBL24075565 0.72 FFAR1 (0.59) PTGESALOX5PTGS1PTGS2APP

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds MCMASTER UNIVERSITY (CA) 2023-10-24 — — 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
US-20210380513-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS MCMASTER UNIVERSITY (CA) 2021-12-09 — — US disclosed
WO-2021237371-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS MCMASTER UNIVERSITY (CA) 2021-12-02 — — 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 (3 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 PTGES 1307/4885ALOX5 18/4885PTGS1 1779/4885
US-20210380513-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR PTGES 1307/4885ALOX5 18/4885PTGS1 1779/4885
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR PTGES 1307/4885ALOX5 18/4885PTGS1 1779/4885

“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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