SCHEMBL661644

SCHEMBL661644

COc1ccc(O)c(C(=O)C=Cc2cccc(OC)c2OC)c1

nearest known ligand 0.77

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR1H4 Q96RI1 1/20 0.66
CHRNA7 P36544 1/20 0.65
AR P10275 4/20 0.61
NPC1 O15118 2/20 0.61
MAPT P10636 2/20 0.61
L3MBTL1 Q9Y468 1/20 0.61
NFE2L2 Q16236 1/20 0.59
ALOX5 P09917 1/20 0.59
MAOB P27338 1/20 0.57
MEN1 O00255 1/20 0.57
MAPK1 P28482 1/20 0.57
RAB9A P51151 1/20 0.57
KMT2A Q03164 1/20 0.57

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
SCHEMBL661643 1.00 NR1H4 (0.66) NR1H4CHRNA7ARNPC1MAPT
SCHEMBL5138238 0.90 MAPT (0.71) NR1H4NPC1MAPTL3MBTL1NFE2L2
SCHEMBL5138233 0.90 MAPT (0.71) NR1H4NPC1MAPTL3MBTL1NFE2L2
SCHEMBL5139199 0.89 NR1H4 (0.83) NR1H4CHRNA7ARNPC1MAPT
SCHEMBL5139197 0.89 NR1H4 (0.83) NR1H4CHRNA7ARNPC1MAPT
SCHEMBL19183067 0.88 AR (0.80) NR1H4ARNFE2L2ALOX5MAOB
SCHEMBL5084423 0.85 MAOB (0.80) NR1H4ARMAPTNFE2L2ALOX5
SCHEMBL5084427 0.85 MAOB (0.80) NR1H4ARMAPTNFE2L2ALOX5
SCHEMBL634386 0.83 CHRNA7 (0.90) NR1H4CHRNA7NPC1MAPTL3MBTL1
SCHEMBL634385 0.83 CHRNA7 (0.90) NR1H4CHRNA7NPC1MAPTL3MBTL1

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 31 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100279987-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF SALIOU CLAUDE 2010-11-04 US claimed
US-7781410-B2 Compositions containing chalcones and use thereof JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2010-08-24 US claimed
EP-2054046-A2 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF Johnson and Johnson Consumer Companies, Inc. (US) 2009-05-06 EP claimed
WO-2008019212-A2 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2008-02-14 WO claimed
US-20080032938-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF JOHNSON & JOHNSON CONSUMER INC. 2008-02-07 US claimed
US-20190008797-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2019-01-10 US disclosed
EP-2605749-B1 COMPOSITIONS COMPRISING PAULOWNIN AND/OR PAULOWNIA EXTRACTS AND USES THEREOF JOHNSON & JOHNSON CONSUMER INC (US) 2017-11-22 EP 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
EP-2605750-B1 COMPOSITIONS COMPRISING PAULOWNIN AND/OR PAULOWNIA EXTRACTS FOR USE IN TREATING INFLAMMATION JOHNSON & JOHNSON CONSUMER INC (US) 2016-12-28 EP disclosed
EP-2605748-B1 USE OF COMPOSITIONS COMPRISING PAULOWNIN AND/OR PAULOWNIA EXTRACTS JOHNSON & JOHNSON CONSUMER INC (US) 2016-12-28 EP disclosed
EP-2605835-B1 COMPOSITIONS COMPRISING PAULOWNIN AND/OR PAULOWNIA EXTRACTS AND USES THEREOF JOHNSON & JOHNSON CONSUMER (US) 2016-03-16 EP disclosed
US-20160038392-A1 COMPOSITIONS COMPRISING PAULOWNIN AND/OR PAULOWNIA EXTRACTS AND USES THEREOF JOHNSON & JOHNSON CONSUMER INC (US) 2016-02-11 US disclosed
WO-2007115181-A9 COMPOUNDS EXHIBITING EFFLUX INHIBITOR ACTIVITY AND COMPOSITIONS AND USES THEREOF EASTMAN CHEM CO (US) 2008-04-03 WO disclosed
EP-1888174-A1 USE OF CHALCONES FOR THE TREATMENT OF VIRAL DISORDERS Johnson and Johnson Consumer Companies, Inc. (US) 2008-02-20 EP 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-2006127539-A1 USE OF CHALCONES FOR THE TREATMENT OF VIRAL DISORDERS JOHNSON & JOHNSON CONSUMER COMPANIES, INC. (US) 2006-11-30 WO disclosed
US-20060270614-A1 Use of chalcones for the treatment of viral disorders JOHNSON & JOHNSON CONSUMER COMPANIES, INC. 2006-11-30 US disclosed
US-20060135445-A1 Breast cancer-resistant protein inhibitor KABUSHIKI KAISHA YAKULT HONSHA (JP) 2006-06-22 US disclosed
EP-1591112-A1 BREAST CANCER-RESISTANT PROTEIN INHIBITOR Kabushiki Kaisha Yakult Honsha (JP) 2005-11-02 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 (7 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 NR1H4 32/4885CHRNA7 684/4885AR 152/4885
US-20060135445-A1 Breast cancer-resistant protein inhibitor ABCC1, BCR, BRCA1 NR1H4 652/4885CHRNA7 4867/4885AR 2096/4885
US-20080032938-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF CYP17A1, HSD17B7, CUTA NR1H4 124/4885CHRNA7 4596/4885AR 103/4885
US-20060270614-A1 Use of chalcones for the treatment of viral disorders HAVCR2, HMGB3, EIF2AK2 NR1H4 704/4885CHRNA7 4811/4885AR 4802/4885
US-20190008797-A1 ESTROGEN RECEPTOR ALPHA COLIGANDS, AND METHODS OF USE THEREOF ESRRG, GPER1, ESR2 NR1H4 46/4885CHRNA7 133/4885AR 143/4885
US-20100279987-A1 COMPOSITIONS CONTAINING CHALCONES AND USE THEREOF CYP17A1, HSD17B7, CUTA NR1H4 124/4885CHRNA7 4596/4885AR 103/4885
US-20160038392-A1 COMPOSITIONS COMPRISING PAULOWNIN AND/OR PAULOWNIA EXTRACTS AND USES THEREOF PNN, CUTA, NCL NR1H4 4864/4885CHRNA7 3058/4885AR 4503/4885

“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.