Demethoxyviridin

Demethoxyviridin

SCHEMBL12464244

C[C@@]12c3ccc4c(c3C(=O)c3occ(c31)C(=O)C[C@H]2O)CCC4=O

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Full drug profile on Sugi Atlas →

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
APP P05067 7/20 1.00
PIK3CA P42336 5/20 1.00
AURKA O14965 1/20 1.00
CDK1 P06493 1/20 1.00
NEK2 P51955 1/20 1.00
PLK1 P53350 1/20 1.00
PIK3R1 P27986 3/20 0.51
EED O75530 2/20 0.43
SUZ12 Q15022 2/20 0.43
EZH2 Q15910 2/20 0.43
RBBP4 Q09028 1/20 0.43
RBBP7 Q16576 1/20 0.43
IDO1 P14902 6/20 0.41
TDO2 P48775 6/20 0.41
FNTA P49354 1/20 0.36
FNTB P49356 1/20 0.36
USP7 Q93009 1/20 0.36

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
Demethoxyviridin SCHEMBL29745916 1.00 APP (1.00) APPPIK3CAAURKACDK1NEK2
Demethoxyviridin SCHEMBL12162246 1.00 APP (1.00) APPPIK3CAAURKACDK1NEK2
SCHEMBL12104109 0.91 APP (0.83) APPPIK3CAAURKACDK1NEK2
SCHEMBL19194687 0.84 APP (0.72) APPPIK3CAAURKACDK1NEK2
SCHEMBL12464245 0.83 APP (1.00) APPPIK3CAAURKACDK1NEK2
SCHEMBL12162245 0.83 APP (1.00) APPPIK3CAAURKACDK1NEK2
SCHEMBL12162279 0.83 APP (1.00) APPPIK3CAAURKACDK1NEK2
SCHEMBL19198458 0.83 APP (1.00) APPPIK3CAAURKACDK1NEK2
Viridin SCHEMBL12162187 0.81 APP (0.68) APPPIK3CAAURKACDK1NEK2
Viridin SCHEMBL150041 0.81 APP (0.68) APPPIK3CAAURKACDK1NEK2

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-11542492-B2 Ligand-directed covalent modification of protein CELGENE CAR LLC (BM) 2023-01-03 US disclosed
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein CELGENE CAR LLC (BM) 2017-08-03 US disclosed
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein CELGENE CAR LLC (BM) 2017-08-03 US disclosed
WO-2011082285-A1 LIGAND-DIRECTED COVALENT MODIFICATION OF PROTEIN AVILA THERAPEUTICS, INC. (US) 2011-07-07 WO disclosed
US-20090274739-A1 METHODS AND COMPOSITIONS FOR TREATING NEOINTIMAL HYPERPLASIA THE TRUSTEES OF COLUMBIA UNIVERSITY IN THE CITY OF NEW YORK (US) 2009-11-05 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 (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-11542492-B2 Ligand-directed covalent modification of protein PTMS, SPR, DNPEP APP 2035/4885PIK3CA 4464/4885AURKA 2444/4885
US-20090274739-A1 METHODS AND COMPOSITIONS FOR TREATING NEOINTIMAL HYPERPLASIA MTOR, RICTOR, RPTOR APP 3190/4885PIK3CA 6/4885AURKA 3941/4885
US-20170218353-A1 Ligand-Directed Covalent Modification of Protein PTMS, SPR, DNPEP APP 2035/4885PIK3CA 4464/4885AURKA 2444/4885

“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.