Beta-Thujaplicinol

Beta-Thujaplicinol

SCHEMBL524720

CC(C)c1ccc(O)c(=O)c(O)c1

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RNASEH1 O60930 1/20 0.62
TYR P14679 3/20 0.57
TRPA1 O75762 1/20 0.57
PTGS1 P23219 1/20 0.57
CACNA1C Q13936 1/20 0.57
ALDH1A1 P00352 2/20 0.55
ALOX12 P18054 2/20 0.55
HTT P42858 2/20 0.55
HIF1A Q16665 2/20 0.55
GAA P10253 1/20 0.55
TDP1 Q9NUW8 5/20 0.52
KDM4E B2RXH2 5/20 0.52
MAPT P10636 4/20 0.52
ALOX15 P16050 2/20 0.52
MDM4 O15151 1/20 0.52
CA1 P00915 1/20 0.52
CA2 P00918 1/20 0.52
TP53 P04637 1/20 0.52
CYP3A4 P08684 1/20 0.52
HPGD P15428 1/20 0.52

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
SCHEMBL23250698 0.83 PTGS1 (0.59) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL6214362 0.83 PTGS1 (0.70) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL23258806 0.82 TRPA1 (0.52) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL9158006 0.82 TRPA1 (0.52) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL23250678 0.82 TRPA1 (0.52) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL23258510 0.82 RNASEH1 (0.56) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL23258824 0.82 RNASEH1 (0.56) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL29362968 0.81 TRPA1 (0.67) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL172232 0.81 TRPA1 (0.67) RNASEH1TYRTRPA1PTGS1CACNA1C
SCHEMBL7442050 0.80 TRPA1 (0.50) RNASEH1TYRTRPA1PTGS1CACNA1C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220339136-A1 LIPOSOMAL TROPONOID COMPOUND FORMULATIONS THE UNITED STATES GOVERNMENT AS REPRESENTED BY THE DEPARTMENT OF VETERANS AFFAIRS 2022-10-27 US disclosed
EP-4021413-A1 LIPOSOMAL TROPONOID COMPOUND FORMULATIONS United States Government as Represented by The Department of Veterans Affairs (US) 2022-07-06 EP disclosed
CN-113105395-B 4-phenylsulfonyl-1-trihydroxy benzoyl piperazine-2-carboxamide derivative and preparation method and application thereof 山东大学 2022-06-17 CN disclosed
US-20210393548-A1 INHIBITORS OF BUNYAVIRIDAE AND USES THEREOF SAINT LOUIS UNIVERSITY (US) 2021-12-23 US disclosed
US-10980754-B2 Anti-fungal compounds SAINT LOUIS UNIVERSITY (US) 2021-04-20 US disclosed
US-20190099385-A1 ANTI-FUNGAL COMPOUNDS SAINT LOUIS UNIVERSITY (US) 2019-04-04 US disclosed
WO-2017184752-A1 ANTI-FUNGAL COMPOUNDS SAINT LOUIS UNIVERSITY (US) 2017-10-26 WO disclosed
US-20130209386-A1 NEW USES EVOCUTIS PLC (GB) 2013-08-15 US disclosed
EP-2598208-A2 NEW USES Evocutis plc (GB) 2013-06-05 EP disclosed
WO-2012172318-A1 FORMULATIONS CONTAINING TROPOLONOIDS, COPPER SALT AND A SOLVENT SYSTEM EVOCUTIS PLC (GB) 2012-12-20 WO disclosed
WO-2012013967-A2 NEW USES SYNTOPIX GROUP PLC (GB) 2012-02-02 WO disclosed
US-20100152301-A1 Treatment of Viral Infections GOVERNMENT OF THE US, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-06-17 US disclosed
US-20100152301-A1 Treatment of Viral Infections GOVERNMENT OF THE US, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2010-06-17 US disclosed
US-20090283473-A1 PLANT MATERIALS EXTRACTION METHOD XYLON BIOTECHNOLOGIES LTD. 2009-11-19 US disclosed
US-20090283473-A1 PLANT MATERIALS EXTRACTION METHOD XYLON BIOTECHNOLOGIES LTD. 2009-11-19 US disclosed
US-20070219141-A1 Plant Materials Extraction Method JONES DAVID 2007-09-20 US disclosed
US-20070219141-A1 Plant Materials Extraction Method JONES DAVID 2007-09-20 US disclosed
WO-2007065007-A9 TREATMENT OF VIRAL INFECTIONS US HEALTH (US) 2007-09-13 WO disclosed
WO-2007065007-A2 TREATMENT OF VIRAL INFECTIONS GOVERNMENT OF THE U.S.A., AS REPERSENTED BY THE SECRETARY, DEPT. OF HEALTH AND HUMAN SERVICES (US) 2007-06-07 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 (6 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-20210393548-A1 INHIBITORS OF BUNYAVIRIDAE AND USES THEREOF HAVCR2, REN, CTSE RNASEH1 20/4885TYR 664/4885TRPA1 3922/4885
US-20070219141-A1 Plant Materials Extraction Method ALPP, PLK4, PGLS RNASEH1 1168/4885TYR 213/4885TRPA1 3148/4885
US-20190099385-A1 ANTI-FUNGAL COMPOUNDS ERG28, NANS, DPM1 RNASEH1 3291/4885TYR 188/4885TRPA1 4519/4885
US-10980754-B2 Anti-fungal compounds ERG28, NANS, DPM1 RNASEH1 3291/4885TYR 188/4885TRPA1 4519/4885
US-20220339136-A1 LIPOSOMAL TROPONOID COMPOUND FORMULATIONS SMPD3, SMPD1, SMPD2 RNASEH1 2963/4885TYR 609/4885TRPA1 1097/4885
US-20100152301-A1 Treatment of Viral Infections CD4, TYMP, DUT RNASEH1 162/4885TYR 4471/4885TRPA1 4885/4885

“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.