Sugi Predict

Sugi Predict / Compounds / SCHEMBL24075554

SCHEMBL24075554

SCHEMBL24075554

CC(C)=CCc1c(O)c(CC=C(C)C)c2c(c1O)C(=O)C[C@@H](c1ccccc1)O2

nearest known ligand 0.83

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 2/20 0.83
▸ KMT2A Q03164 2/20 0.83
▸ MEN1 O00255 1/20 0.83
▸ POLB P06746 1/20 0.83
▸ XBP1 P17861 1/20 0.83
▸ ABCG2 Q9UNQ0 3/20 0.76
▸ CYP3A4 P08684 1/20 0.76
▸ CYP2D6 P10635 1/20 0.76
▸ CYP2C9 P11712 1/20 0.76
▸ ACHE P22303 1/20 0.76
▸ CYP2C19 P33261 1/20 0.76
▸ IDO1 P14902 1/20 0.67
▸ ESR1 P03372 4/20 0.63
▸ CACNA1H O95180 3/20 0.63
▸ ESR2 Q92731 2/20 0.63
▸ CACNA1G O43497 2/20 0.63
▸ AKR1B10 O60218 1/20 0.63
▸ AKR1B1 P15121 1/20 0.63
▸ MAOA P21397 1/20 0.63
▸ PDE5A O76074 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
Lonchocarpol A SCHEMBL31091681 0.91 MAPT (1.00) MAPTKMT2AMEN1POLBXBP1
Lonchocarpol A SCHEMBL144277 0.91 MAPT (1.00) MAPTKMT2AMEN1POLBXBP1
Lonchocarpol A SCHEMBL144276 0.91 MAPT (1.00) MAPTKMT2AMEN1POLBXBP1
Microfolione SCHEMBL30321441 0.88 MAPT (0.66) MAPTKMT2AMEN1POLBXBP1
Glabranin SCHEMBL320135 0.86 CYP3A4 (1.00) MAPTKMT2AMEN1POLBXBP1
Glabranin SCHEMBL320136 0.86 CYP3A4 (1.00) MAPTKMT2AMEN1POLBXBP1
SCHEMBL31570921 0.86 ABCG2 (1.00) MAPTKMT2AMEN1POLBXBP1
SCHEMBL16212472 0.86 MAPT (0.78) MAPTKMT2AMEN1POLBXBP1
SCHEMBL29851740 0.86 MAPT (0.78) MAPTKMT2AMEN1POLBXBP1
SCHEMBL29527169 0.83 CYP3A4 (0.68) MAPTKMT2AMEN1POLBXBP1

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 MAPT 4076/4885KMT2A 1119/4885MEN1 2952/4885
US-20210380513-A1 PROCESSES FOR THE PREPARATION OF ORTHO-ALLYLATED HYDROXY ARYL COMPOUNDS ADH1A, ADH1C, AHR MAPT 4076/4885KMT2A 1119/4885MEN1 2952/4885
US-11795127-B2 Processes for the preparation of ortho-allylated hydroxy aryl compounds ADH1A, ADH1C, AHR MAPT 4076/4885KMT2A 1119/4885MEN1 2952/4885

“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.