SCHEMBL2053786

SCHEMBL2053786

CC(C)=CCc1c(O)cc2oc3ccc(C(=O)O)c(CC=C(C)C)c3c(=O)c2c1O

nearest known ligand 0.72

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGAM O43451 6/20 0.72
GAA P10253 5/20 0.72
SI P14410 5/20 0.72
MGAM2 Q2M2H8 5/20 0.72
NUDT1 P36639 4/20 0.72
FASN P49327 4/20 0.72
CYP19A1 P11511 4/20 0.72
IDH1 O75874 4/20 0.72
PTPN1 P18031 4/20 0.72
PGAM1 P18669 3/20 0.72
SIRT2 Q8IXJ6 3/20 0.72
AKR1B1 P15121 2/20 0.72
TTR P02766 1/20 0.72
PTGS1 P23219 1/20 0.72
PTGS2 P35354 1/20 0.72
SIRT1 Q96EB6 1/20 0.72
SIRT3 Q9NTG7 1/20 0.72
RELA Q04206 3/20 0.65
KDM4E B2RXH2 2/20 0.65
MAPT P10636 2/20 0.65

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
SCHEMBL3416398 0.87 MGAM (0.81) MGAMGAASIMGAM2NUDT1
SCHEMBL29460081 0.84 MGAM (1.00) MGAMGAASIMGAM2NUDT1
SCHEMBL30634827 0.84 MGAM (1.00) MGAMGAASIMGAM2NUDT1
SCHEMBL3753526 0.84 MGAM (1.00) MGAMGAASIMGAM2NUDT1
SCHEMBL5613424 0.82 NUDT1 (0.76) MGAMGAASIMGAM2NUDT1
SCHEMBL12241934 0.82 MGAM (0.81) MGAMGAASIMGAM2NUDT1
SCHEMBL12430368 0.82 MGAM (0.81) MGAMGAASIMGAM2NUDT1
SCHEMBL13081216 0.81 MGAM (0.79) MGAMGAASIMGAM2NUDT1
Mangostin SCHEMBL27218086 0.81 MGAM (0.93) MGAMGAASIMGAM2NUDT1
Mangostin SCHEMBL354735 0.79 MGAM (1.00) MGAMGAASIMGAM2NUDT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1824442-A1 PHARMACEUTICAL AND THERAPEUTIC COMPOSITIONS DERIVED FROM GARCINIA MANGOSTANA L PLANT Renaissance Herbs, Inc. (US) 2007-08-29 EP claimed
WO-2007002666-A2 PHARMACEUTICAL AND THERAPEUTIC COMPOSTIONS DERIVED FROM GARCINIA MANGOSTANA L PLANT RENAISSANCE HERBS, INC. (US) 2007-01-04 WO claimed
US-20060292255-A1 Pharmaceutical and therapeutic compositions derived from Garcinia mangostana L plant RENAISSSANCE HERBS INC. 2006-12-28 US claimed
WO-2006055688-A1 PHARMACEUTICAL AND THERAPEUTIC COMPOSITIONS DERIVED FROM GARCINIA MANGOSTANA L PLANT RENAISSANCE HERBS, INC. (US) 2006-05-26 WO claimed
US-20060105069-A1 Pharmaceutical and therapeutic compositions derived from Garcinia mangostana L plant RENAISSANCE HERBS, INC. 2006-05-18 US claimed
EP-3110414-B1 XANTHONE-RICH PLANT EXTRACTS OR COMPOUNDS THEREFROM FOR MODULATING DISEASES OF THE CENTRAL NERVOUS SYSTEM AND RELATED DISORDERS UNIV DEAKIN (AU) 2020-09-30 EP disclosed
US-10568862-B2 Xanthone-rich plant extracts or compounds therefrom for modulating diseases of the central nervous system and related disorders DEAKIN UNIVERSITY (AU) 2020-02-25 US disclosed
US-20160367521-A1 XANTHONE-RICH PLANT EXTRACTS OR COMPOUNDS THEREFROM FOR MODULATING DISEASES OF THE CENTRAL NERVOUS SYSTEM AND RELATED DISORDERS DEAKIN UNIVERSITY (AU) 2016-12-22 US disclosed
US-20160367521-A1 XANTHONE-RICH PLANT EXTRACTS OR COMPOUNDS THEREFROM FOR MODULATING DISEASES OF THE CENTRAL NERVOUS SYSTEM AND RELATED DISORDERS DEAKIN UNIVERSITY (AU) 2016-12-22 US disclosed
WO-2015127512-A1 XANTHONE-RICH PLANT EXTRACTS OR COMPOUNDS THEREFROM FOR MODULATING DISEASES OF THE CENTRAL NERVOUS SYSTEM AND RELATED DISORDERS DEAKIN UNIVERSITY (AU) 2015-09-03 WO disclosed
CN-103597071-A Chemosensory receptor ligand-based therapies ELCELYX THERAPEUTICS INC 2014-02-19 CN disclosed
EP-2689805-A1 Oral compositions containing extracts of garcinia mangostana l. and related methods Colgate-Palmolive Company (US) 2014-01-29 EP disclosed
EP-2506933-A1 ORAL COMPOSITIONS CONTAINING EXTRACTS OF GARCINIA MANGOSTANA L. AND RELATED METHODS Colgate-Palmolive Company (US) 2012-10-10 EP disclosed
US-20120237456-A1 ORAL COMPOSITIONS CONTAINING EXTRACTS OF GARCINIA MANGOSTANA L. AND RELATED METHODS COLGATE-PALMOLIVE COMPANY (US) 2012-09-20 US disclosed
WO-2011068814-A1 ORAL COMPOSITIONS CONTAINING EXTRACTS OF GARCINIA MANGOSTANA L. AND RELATED METHODS COLGATE-PALMOLIVE COMPANY (US) 2011-06-09 WO disclosed
EP-1824442-A1 PHARMACEUTICAL AND THERAPEUTIC COMPOSITIONS DERIVED FROM GARCINIA MANGOSTANA L PLANT Renaissance Herbs, Inc. (US) 2007-08-29 EP disclosed
WO-2007002666-A2 PHARMACEUTICAL AND THERAPEUTIC COMPOSTIONS DERIVED FROM GARCINIA MANGOSTANA L PLANT RENAISSANCE HERBS, INC. (US) 2007-01-04 WO disclosed
US-20060292255-A1 Pharmaceutical and therapeutic compositions derived from Garcinia mangostana L plant RENAISSSANCE HERBS INC. 2006-12-28 US disclosed
WO-2006055688-A1 PHARMACEUTICAL AND THERAPEUTIC COMPOSITIONS DERIVED FROM GARCINIA MANGOSTANA L PLANT RENAISSANCE HERBS, INC. (US) 2006-05-26 WO disclosed
US-20060105069-A1 Pharmaceutical and therapeutic compositions derived from Garcinia mangostana L plant RENAISSANCE HERBS, INC. 2006-05-18 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-10568862-B2 Xanthone-rich plant extracts or compounds therefrom for modulating diseases of the central nervous system and related disorders GAP43, PMP22, ACHE MGAM 1497/4885GAA 495/4885SI 3955/4885
US-20160367521-A1 XANTHONE-RICH PLANT EXTRACTS OR COMPOUNDS THEREFROM FOR MODULATING DISEASES OF THE CENTRAL NERVOUS SYSTEM AND RELATED DISORDERS GAP43, PMP22, ACHE MGAM 1497/4885GAA 495/4885SI 3955/4885
US-20120237456-A1 ORAL COMPOSITIONS CONTAINING EXTRACTS OF GARCINIA MANGOSTANA L. AND RELATED METHODS GLA, ALPP, LIPA MGAM 84/4885GAA 9/4885SI 8/4885

“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.