SCHEMBL5138233

SCHEMBL5138233

COc1ccc(C(=O)/C=C/c2cccc(OC)c2OC)c(O)c1

nearest known ligand 0.77

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 3/20 0.71
NPC1 O15118 2/20 0.71
RAB9A P51151 2/20 0.71
MEN1 O00255 2/20 0.71
MAPK1 P28482 2/20 0.71
KMT2A Q03164 2/20 0.71
APP P05067 3/20 0.70
ABCG2 Q9UNQ0 5/20 0.67
NR1H4 Q96RI1 2/20 0.66
ALOX5 P09917 1/20 0.62
LMNA P02545 2/20 0.62
RECQL P46063 1/20 0.62
ATM Q13315 1/20 0.62
L3MBTL1 Q9Y468 1/20 0.62
FLT3 P36888 1/20 0.61
PTPN1 P18031 1/20 0.61
CYP3A4 P08684 1/20 0.61
CYP2C19 P33261 1/20 0.61
SMN1; SMN2 Q16637 1/20 0.61
CTSL P07711 1/20 0.59

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
SCHEMBL5138238 1.00 MAPT (0.71) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL634205 0.91 NR1H4 (0.79) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL634206 0.91 NR1H4 (0.79) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL661643 0.90 NR1H4 (0.66) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL661644 0.90 NR1H4 (0.66) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL4449583 0.89 MAPT (0.77) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL4449587 0.89 MAPT (0.77) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL331296 0.89 NR1H4 (0.83) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL633204 0.89 NR1H4 (0.83) MAPTNPC1RAB9AMEN1MAPK1
SCHEMBL5084423 0.85 MAOB (0.80) MAPTABCG2NR1H4ALOX5LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20190008797-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-01-10 US disclosed
US-9763961-B2 Compositions that modulate the activity of estrogen receptors and estrogen-related receptors and methods for use CITY OF HOPE (US) 2017-09-19 US disclosed
US-9763961-B2 Compositions that modulate the activity of estrogen receptors and estrogen-related receptors and methods for use CITY OF HOPE (US) 2017-09-19 US disclosed
WO-2017132135-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2017-08-03 WO disclosed
US-20100279987-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF SALIOU CLAUDE 2010-11-04 US disclosed
US-20100279987-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF SALIOU CLAUDE 2010-11-04 US disclosed
US-7781410-B2 Compositions containing chalcones and use thereof JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2010-08-24 US disclosed
US-7781410-B2 Compositions containing chalcones and use thereof JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2010-08-24 US disclosed
US-20090124688-A1 Prostaglandin reductase inhibitors ABGENOMICS CORPORATION (TW) 2009-05-14 US disclosed
US-20090124688-A1 Prostaglandin reductase inhibitors ABGENOMICS CORPORATION (TW) 2009-05-14 US disclosed
WO-2007115181-A9 COMPOUNDS EXHIBITING EFFLUX INHIBITOR ACTIVITY AND COMPOSITIONS AND USES THEREOF EASTMAN CHEM CO (US) 2008-04-03 WO disclosed
US-20080032938-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF JOHNSON & JOHNSON CONSUMER INC. 2008-02-07 US disclosed
US-20080032938-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF JOHNSON & JOHNSON CONSUMER INC. 2008-02-07 US disclosed
US-20070254859-A1 Compounds exhibiting efflux inhibitor activity and composition and uses thereof EASTMAN CHEMICAL COMPANY 2007-11-01 US disclosed
WO-2007115181-A2 COMPOUNDS EXHIBITING EFFLUX INHIBITOR ACTIVITY AND COMPOSITIONS AND USES THEREOF EASTMAN CHEMICAL COMPANY (US) 2007-10-11 WO disclosed
WO-2007082178-A2 PROSTAGLANDIN REDUCTASE INHIBITORS ABGENOMICS CORPORATION (TW) 2007-07-19 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 (5 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-20070254859-A1 Compounds exhibiting efflux inhibitor activity and composition and uses thereof ABCC4, NCOA4, NR4A3 MAPT 4566/4885NPC1 362/4885RAB9A 3126/4885
US-20080032938-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF CYP17A1, HSD17B7, CUTA MAPT 2236/4885NPC1 344/4885RAB9A 4564/4885
US-20190008797-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF ESRRG, GPER1, ESR2 MAPT 4210/4885NPC1 4155/4885RAB9A 3745/4885
US-20100279987-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF CYP17A1, HSD17B7, CUTA MAPT 2236/4885NPC1 344/4885RAB9A 4564/4885
US-20090124688-A1 Prostaglandin reductase inhibitors PTGIR, PTGDR, PTGDR2 MAPT 4718/4885NPC1 1055/4885RAB9A 3758/4885

“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.