SCHEMBL5313573

SCHEMBL5313573

C=C(c1ccccc1)c1ccc(O)c(C(=O)O)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HNF4A P41235 4/20 0.53
ACMSD Q8TDX5 4/20 0.53
MCL1 Q07820 2/20 0.53
DHFR P00374 1/20 0.53
CA1 P00915 3/20 0.50
CA2 P00918 3/20 0.50
CA12 O43570 2/20 0.50
CA7 P43166 2/20 0.50
CA9 Q16790 2/20 0.50
CA14 Q9ULX7 2/20 0.50
PTGS2 P35354 2/20 0.50
ALOX5 P09917 1/20 0.50
PTPN1 P18031 3/20 0.49
KDM4E B2RXH2 4/20 0.48
ALDH1A1 P00352 3/20 0.48
HPGD P15428 3/20 0.48
HMGB1 P09429 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
SMN1; SMN2 Q16637 1/20 0.48

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
SCHEMBL1048685 0.94 CA1 (0.55) HNF4AACMSDMCL1DHFRCA1
SCHEMBL7711866 0.89 MCL1 (0.58) HNF4AACMSDMCL1DHFRCA1
SCHEMBL10728975 0.87 MEN1 (0.46) HNF4AACMSDMCL1DHFRCA1
SCHEMBL6539439 0.86 CA12 (0.52) HNF4AACMSDMCL1DHFRCA1
SCHEMBL7706125 0.85 ACMSD (0.49) HNF4AACMSDMCL1DHFRCA1
SCHEMBL7709289 0.85 ACMSD (0.49) HNF4AACMSDMCL1DHFRCA1
SCHEMBL15882918 0.82 CA1 (0.71) HNF4AACMSDMCL1DHFRCA1
SCHEMBL489842 0.81 TDP1 (0.59) HNF4AACMSDMCL1DHFRCA1
SCHEMBL29417548 0.81 TDP1 (0.59) HNF4AACMSDMCL1DHFRCA1
SCHEMBL7895174 0.81 ACMSD (0.53) HNF4AACMSDMCL1DHFRCA1

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
WO-2007047815-A2 DIAGNOSIS OF TRANSMISSIBLE SPONGIFORM ENCEPHALOPATHY THE BRIGHAM AND WOMEN'S HOSPITAL, INC. (US) 2007-04-26 WO claimed
CN-110208540-B Methods and compositions for the detection and treatment of preeclampsia 耶鲁大学 2024-02-09 CN disclosed
CN-110187119-B Methods and compositions for the detection and treatment of preeclampsia 耶鲁大学 2022-07-29 CN disclosed
CN-110187120-B Methods and compositions for the detection and treatment of preeclampsia 耶鲁大学 2022-07-01 CN disclosed
CN-110187121-B Methods and compositions for the detection and treatment of preeclampsia 耶鲁大学 2022-07-01 CN disclosed
CN-104777307-B The method and composition of pre-eclampsia detection and treatment 耶鲁大学 2019-10-18 CN disclosed
CN-105044347-A Methods and compositions for the detection and treatment of preeclampsia UNIV YALE 2015-11-11 CN disclosed
CN-105021821-A ETHODS AND COMPOSITIONS FOR THE DETECTION AND TREATMENT OF PREECLAMPSIA UNIV YALE 2015-11-04 CN disclosed
CN-104777307-A Methods and compositions for the detection and treatment of preeclampsia UNIV YALE 2015-07-15 CN disclosed
CN-104777308-A Methods and compositions for the detection and treatment of preeclampsia UNIV YALE 2015-07-15 CN disclosed
CN-102483418-B Methods and compositions for the detection and treatment of preeclampsia UNIV YALE 2015-01-07 CN disclosed
CN-102483418-A Methods and compositions for the detection and treatment of preeclampsia UNIV YALE 2012-05-30 CN disclosed
WO-1999024394-A9 COMPOUNDS FOR THE ANTEMORTEM DIAGNOSIS OF ALZHEIMER'S DISEASE AND IN VIVO IMAGING AND PREVENTION OF AMYLOID DEPOSITION UNIV PITTSBURGH (US) 2001-05-31 WO disclosed
US-6168776-B1 Alkyl, alkenyl and alkynyl Chrysamine G derivatives for the antemortem diagnosis of Alzheimer's disease and in vivo imaging and prevention of amyloid deposition UNIVERSITY OF PITTSBURGH 2001-01-02 US disclosed
EP-1028941-A2 COMPOUNDS FOR THE ANTEMORTEM DIAGNOSIS OF ALZHEIMER'S DISEASE AND IN VIVO IMAGING AND PREVENTION OF AMYLOID DEPOSITION UNIVERSITY OF PITTSBURGH (US) 2000-08-23 EP disclosed
WO-1999024394-A2 COMPOUNDS FOR THE ANTEMORTEM DIAGNOSIS OF ALZHEIMER'S DISEASE AND IN VIVO IMAGING AND PREVENTION OF AMYLOID DEPOSITION UNIVERSITY OF PITTSBURGH (US) 1999-05-20 WO disclosed