SCHEMBL24075552

SCHEMBL24075552

COc1cc([C@@H]2CC(=O)c3c(cc(O)c(C/C=C(\C)CCC=C(C)C)c3O)O2)ccc1O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 10/20 1.00
ACHE P22303 6/20 0.87
ALOX5 P09917 3/20 0.85
PTGS2 P35354 4/20 0.84
TP53 P04637 1/20 0.78
MDM2 Q00987 1/20 0.78
PTPN1 P18031 1/20 0.66
CACNA1G O43497 1/20 0.64
CACNA1H O95180 1/20 0.64
ESR1 P03372 1/20 0.64
MAPT P10636 1/20 0.64
MAPK1 P28482 1/20 0.64
KMT2A Q03164 1/20 0.64
ATM Q13315 1/20 0.64
NPSR1 Q6W5P4 1/20 0.64
PDCD1 Q15116 1/20 0.63
CD274 Q9NZQ7 1/20 0.63

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
SCHEMBL18061379 1.00 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
SCHEMBL18061371 0.93 ELANE (0.88) ELANEACHEALOX5PTGS2TP53
SCHEMBL30637565 0.93 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
SCHEMBL24075553 0.93 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
SCHEMBL18061380 0.93 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
SCHEMBL30637395 0.92 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
SCHEMBL18037686 0.92 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
SCHEMBL18037687 0.92 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
Nymphaeol A SCHEMBL7795014 0.90 ELANE (1.00) ELANEACHEALOX5PTGS2TP53
Nymphaeol A SCHEMBL909992 0.90 ELANE (1.00) ELANEACHEALOX5PTGS2TP53

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 4 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-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 ELANE 1548/4885ACHE 2560/4885ALOX5 18/4885
US-20210380513-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR ELANE 1548/4885ACHE 2560/4885ALOX5 18/4885
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR ELANE 1548/4885ACHE 2560/4885ALOX5 18/4885

“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.