SCHEMBL4490735

SCHEMBL4490735

COc1c(C)cc(O)c(OC)c1OC

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.54
PTPN1 P18031 2/20 0.43
MAPT P10636 5/20 0.41
CYP3A4 P08684 3/20 0.41
TPMT P51580 4/20 0.39
ALDH1A1 P00352 4/20 0.39
KDM4E B2RXH2 4/20 0.39
HPGD P15428 2/20 0.39
HSD17B10 Q99714 2/20 0.39
CYP1A2 P05177 1/20 0.39
CYP2D6 P10635 1/20 0.39
G6PD P11413 1/20 0.39
CYP2C9 P11712 1/20 0.39
PKM P14618 1/20 0.39
ALOX15 P16050 1/20 0.39
ALOX12 P18054 1/20 0.39
MAPK1 P28482 1/20 0.39
CYP2C19 P33261 1/20 0.39
CCR6 P51684 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL29421972 1.00 TDP1 (0.54) TDP1PTPN1MAPTCYP3A4TPMT
SCHEMBL28272590 0.83 TDP1 (0.52) TDP1PTPN1MAPTCYP3A4TPMT
SCHEMBL27694686 0.83 TDP1 (0.52) TDP1PTPN1MAPTCYP3A4TPMT
SCHEMBL29727382 0.83 TDP1 (0.58) TDP1PTPN1MAPTCYP3A4TPMT
SCHEMBL1961832 0.83 TDP1 (0.58) TDP1PTPN1MAPTCYP3A4TPMT
SCHEMBL28274926 0.83 TDP1 (0.52) TDP1PTPN1MAPTCYP3A4ALDH1A1
SCHEMBL8249793 0.83 TDP1 (0.52) TDP1PTPN1MAPTCYP3A4TPMT
SCHEMBL7554717 0.82 HTT (0.56) TDP1MAPTTPMTALDH1A1KDM4E
SCHEMBL8254929 0.81 ACHE (0.46) TDP1PTPN1MAPTCYP3A4ALDH1A1
SCHEMBL31090180 0.78 PTPN1 (0.53) TDP1PTPN1MAPTCYP3A4TPMT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1915333-B1 PROCESS FOR THE PREPARATION OF UBIHYDROQUINONES AND UBIQUINONES DSM IP ASSETS BV (NL) 2015-06-03 EP disclosed
CN-101243031-B Process for preparing ubiquinones and ubiquinones DSM IP ASSETS BV 2012-05-09 CN disclosed
US-7601877-B2 Condensation of a prenol or isoprenol with a hydroquinone or derivative in the presence of 0.005-1.0 mol percent of a Bronsted or Lewis acid catalyst selected from a bismuth, indium or Group 3 chloride, a heteropolyacid, and an NH- or a CH-acidic compound, oxidizing the ubihydroquinone; improved kinetics DSM IP ASSETS B.V. (NL) 2009-10-13 US disclosed
US-20080275275-A1 Process for the Preparation of Ubihydroquinones and Ubiquinones DSM IPASSETS B.V. (NL) 2008-11-06 US disclosed
EP-1915333-A1 PROCESS FOR THE PREPARATION OF UBIHYDROQUINONES AND UBIQUINONES DSMIP Assets B.V. (NL) 2008-04-30 EP disclosed
WO-2007017168-A1 PROCESS FOR THE PREPARATION OF UBIHYDROQUINONES AND UBIQUINONES DSM IP ASSETS B.V. (NL) 2007-02-15 WO disclosed
US-4992469-A Prevention of cardiovascular disorder; phospholipase inhibitor EISAI CO., LTD. (JP) 1991-02-12 US disclosed
EP-0163317-B1 QUINONE DERIVATIVES, METHOD AND USE OF PREPARING SAME, AND PHARMACEUTICAL COMPOSITION Eisai Co., Ltd. (JP) 1988-08-24 EP disclosed
EP-0163317-A1 Quinone derivatives, method and use of preparing same, and pharmaceutical composition Eisai Co., Ltd. (JP) 1985-12-04 EP 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 (1 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-20080275275-A1 Process for the Preparation of Ubihydroquinones and Ubiquinones UBE2D3, UBE2L3, UBE2I TDP1 4456/4885PTPN1 4654/4885MAPT 2939/4885

“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.