SCHEMBL24075657

SCHEMBL24075657

CC(C)=CCc1c(O)cc(O)c(C(=O)c2ccccc2)c1O

nearest known ligand 0.60

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMPD1 P17405 2/20 0.60
ALOX5 P09917 2/20 0.54
PTGES O14684 1/20 0.54
PTGS1 P23219 1/20 0.54
PTGS2 P35354 1/20 0.54
MAPT P10636 2/20 0.50
MEN1 O00255 1/20 0.50
LMNA P02545 1/20 0.50
HPGD P15428 1/20 0.50
HTT P42858 1/20 0.50
KMT2A Q03164 1/20 0.50
CNR2 P34972 1/20 0.49
CTSL P07711 1/20 0.47
ABCG2 Q9UNQ0 1/20 0.47
PTPN1 P18031 2/20 0.47
APP P05067 1/20 0.47
BACE1 P56817 1/20 0.47
MGAM O43451 1/20 0.46
PPARG P37231 2/20 0.46
PPARD Q03181 2/20 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
SCHEMBL24075663 0.89 ALOX5 (0.73) ALOX5PTGESPTGS1PTGS2CNR2
SCHEMBL24074940 0.88 PPARG (0.49) SMPD1ALOX5PTGESPTGS1PTGS2
Cudraphenone D SCHEMBL31345866 0.82 SMPD1 (0.62) SMPD1ALOX5PTGESPTGS1PTGS2
SCHEMBL31345890 0.82 PPARG (0.66) SMPD1ALOX5PTGESMAPTMEN1
SCHEMBL9578229 0.82 ALOX5 (0.76) SMPD1ALOX5PTGESPTGS1PTGS2
SCHEMBL31576819 0.82 ALOX5 (0.76) SMPD1ALOX5PTGESPTGS1PTGS2
SCHEMBL31230884 0.80 CTSL (0.69) SMPD1ALOX5PTGESPTGS1PTGS2
SCHEMBL24074934 0.79 PTGES (0.60) ALOX5PTGESPTGS1PTGS2CNR2
SCHEMBL30100945 0.78 PTGS1 (0.58) SMPD1ALOX5PTGESPTGS1PTGS2
SCHEMBL31345875 0.77 PPARG (0.63) SMPD1ALOX5PTGESMAPTMEN1

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 SMPD1 4566/4885ALOX5 18/4885PTGES 1307/4885
US-20210380513-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR SMPD1 4566/4885ALOX5 18/4885PTGES 1307/4885
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR SMPD1 4566/4885ALOX5 18/4885PTGES 1307/4885

“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.