SCHEMBL1743353

SCHEMBL1743353

COc1cc(/C=C/c2ccc(OC)c(O)c2)cc(OC)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALOX5 P09917 4/20 1.00
NQO2 P16083 3/20 1.00
NQO1 P15559 1/20 1.00
APP P05067 1/20 0.75
TUBB1 Q9H4B7 8/20 0.73
TTR P02766 2/20 0.72
CYP1A1 P04798 2/20 0.72
CYP1B1 Q16678 2/20 0.72
ABCG2 Q9UNQ0 1/20 0.72
MYC P01106 1/20 0.72
ABCB1 P08183 3/20 0.71
TUBB4A P04350 2/20 0.71
TUBB P07437 2/20 0.71
TUBA3C P0DPH7 2/20 0.71
TUBA1B P68363 2/20 0.71
TUBA4A P68366 2/20 0.71
TUBB4B P68371 2/20 0.71
TUBB3 Q13509 2/20 0.71
TUBB2A Q13885 2/20 0.71
TUBB8 Q3ZCM7 2/20 0.71

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
SCHEMBL2966533 1.00 ALOX5 (1.00) ALOX5NQO2NQO1APPTUBB1
SCHEMBL1743354 1.00 ALOX5 (1.00) ALOX5NQO2NQO1APPTUBB1
SCHEMBL28444241 0.93 ALOX5 (0.88) ALOX5NQO2NQO1APPTUBB1
SCHEMBL28445854 0.93 ALOX5 (0.88) ALOX5NQO2NQO1APPTUBB1
SCHEMBL6781119 0.88 NQO2 (0.78) ALOX5NQO2NQO1APPTUBB1
SCHEMBL6781126 0.88 NQO2 (0.78) ALOX5NQO2NQO1APPTUBB1
SCHEMBL16307442 0.87 ALOX5 (0.76) ALOX5NQO2NQO1APPTUBB1
SCHEMBL25328702 0.86 ALOX5 (1.00) ALOX5NQO2NQO1APPTUBB1
SCHEMBL25328697 0.86 ALOX5 (1.00) ALOX5NQO2NQO1APPTUBB1
SCHEMBL3390342 0.86 APP (1.00) ALOX5NQO2NQO1APPTUBB1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103172512-B A group of compounds with similar cajanin structure, preparation method and application 中国医学科学院医药生物技术研究所 2016-08-03 CN claimed
CN-105030750-A Application of longistyline structural analogues in prevention of hepatitis C virus and acquired immune deficiency syndrome (AIDS) virus INST MED BIOTECHNOLOGY CAMS 2015-11-11 CN claimed
US-20140371232-A1 CAJANINE STRUCTURE ANALOGOUS COMPOUND, PREPARATION METHOD AND USE INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2014-12-18 US claimed
EP-2796442-A1 CAJANINE STRUCTURE ANALOGOUS COMPOUND, PREPARATION METHOD AND USE Institute of Medicinal Biotechnology, Chinese Academy of Medical Sciences (CN) 2014-10-29 EP claimed
CN-103172512-A A group of compounds with similar cajanin structure, preparation method and application INST MEDICINAL BIOTECHNOLOGY 2013-06-26 CN claimed
US-20210115007-A1 STREPTOCOCCUS MUTANS GLUCOSYL TRANSFERASE INHIBITORS FOR DENTAL CARIES THERAPY NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2021-04-22 US disclosed
WO-2019195430-A1 STREPTOCOCCUS MUTANS GLUCOSYL TRANSFERASE INHIBITORS FOR DENTAL CARIES THERAPY UAB RESEARCH FOUNDATION (US) 2019-10-10 WO disclosed
CN-105030750-B Application of one group of cajanin structurally similar compounds in anti-hepatitis C virus and anti AIDS virus 中国医学科学院医药生物技术研究所 2018-08-28 CN disclosed
CN-103172512-B A group of compounds with similar cajanin structure, preparation method and application 中国医学科学院医药生物技术研究所 2016-08-03 CN disclosed
US-9359298-B2 Cajanine structure analogous compound, preparation method and use INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2016-06-07 US disclosed
US-9359298-B2 Cajanine structure analogous compound, preparation method and use INSTITUTE OF MEDICINAL BIOTECHNOLOGY, CHINESE ACADEMY OF MEDICAL SCIENCES (CN) 2016-06-07 US disclosed
CN-105030750-A Application of longistyline structural analogues in prevention of hepatitis C virus and acquired immune deficiency syndrome (AIDS) virus INST MED BIOTECHNOLOGY CAMS 2015-11-11 CN disclosed
WO-2011141458-A1 POLYSUBSTITUTED BENZOFURANS AND MEDICINAL APPLICATIONS THEREOF IKERCHEM, S.L. (ES) 2011-11-17 WO disclosed
US-8038466-B1 Power receptacle with enlarged heat dissipation path formed on mating face and power connector assembly thereof ALLTOP ELECTRONICS (SUZHOU) CO., LTD (CN) 2011-10-18 US disclosed
US-20100310615-A1 COMPOSITIONS COMPRISING STILBENE POLYPHENOL DERIVATIVES AND USE THEREOF FOR COMBATING THE AGEING OF LIVING ORGANISMS AND DISEASES AFFECTING SAME CAUDALIE (FR) 2010-12-09 US disclosed
US-20100310615-A1 COMPOSITIONS COMPRISING STILBENE POLYPHENOL DERIVATIVES AND USE THEREOF FOR COMBATING THE AGEING OF LIVING ORGANISMS AND DISEASES AFFECTING SAME CAUDALIE (FR) 2010-12-09 US disclosed
WO-2008131320-A1 STILBENE DERIVATIVES AS NEW CANCER THERAPEUTIC AGENTS VIRGINIA COMMONWEALTH UNIVERSITY (US) 2008-10-30 WO disclosed
US-20080261982-A1 STILBENE DERIVATIVES AS NEW CANCER THERAPEUTIC AGENTS VIRGINIA COMMONWEALTH UNIVERSITY 2008-10-23 US disclosed
US-20080261982-A1 STILBENE DERIVATIVES AS NEW CANCER THERAPEUTIC AGENTS VIRGINIA COMMONWEALTH UNIVERSITY 2008-10-23 US disclosed
US-20080261982-A1 STILBENE DERIVATIVES AS NEW CANCER THERAPEUTIC AGENTS VIRGINIA COMMONWEALTH UNIVERSITY 2008-10-23 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 (4 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-20080261982-A1 STILBENE DERIVATIVES AS NEW CANCER THERAPEUTIC AGENTS HDGF, TIE1, VEGFA ALOX5 1084/4885NQO2 4026/4885NQO1 1746/4885
US-20140371232-A1 CAJANINE STRUCTURE ANALOGOUS COMPOUND, PREPARATION METHOD AND USE ACHE, GAP43, LNPK ALOX5 2183/4885NQO2 4644/4885NQO1 3634/4885
US-20210115007-A1 STREPTOCOCCUS MUTANS GLUCOSYL TRANSFERASE INHIBITORS FOR DENTAL CARIES THERAPY UGGT1, UGCG, GLA ALOX5 1521/4885NQO2 389/4885NQO1 912/4885
US-20100310615-A1 COMPOSITIONS COMPRISING STILBENE POLYPHENOL DERIVATIVES AND USE THEREOF FOR COMBATING THE AGEING OF LIVING ORGANISMS AND DISEASES AFFECTING SAME PPARG, PPARA, PC ALOX5 203/4885NQO2 467/4885NQO1 40/4885

“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.