SCHEMBL2742469

SCHEMBL2742469

COc1cc2c(cc1O)CCN1Cc3c(ccc(OC)c3OC)C[C@H]21

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD1 P21728 17/20 1.00
DRD2 P14416 13/20 1.00
DRD3 P35462 9/20 1.00
DRD5 P21918 5/20 1.00
SIGMAR1 Q99720 5/20 0.91
DRD4 P21917 2/20 0.91
F3 P13726 5/20 0.89
ADRA1D P25100 1/20 0.87
ADRA1A P35348 1/20 0.87
ADRA1B P35368 1/20 0.87
CYP3A4 P08684 2/20 0.83
LMNA P02545 2/20 0.81
TSHR P16473 1/20 0.81
HTR1A P08908 1/20 0.78
KDM4E B2RXH2 1/20 0.74
CYP1A2 P05177 1/20 0.74
CYP2D6 P10635 1/20 0.74
CASP1 P29466 1/20 0.74
CYP2C19 P33261 1/20 0.74
APAF1 O14727 1/20 0.74

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
SCHEMBL29999180 1.00 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL21192511 1.00 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL231003 1.00 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL16035972 0.95 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL14703846 0.95 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL680031 0.95 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL29561422 0.95 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL13334113 0.94 DRD1 (1.00) DRD1DRD2DRD3DRD5SIGMAR1
Hydrochloric Acid SCHEMBL3321082 0.93 DRD1 (0.98) DRD1DRD2DRD3DRD5SIGMAR1
SCHEMBL2742673 0.91 DRD1 (0.85) DRD1DRD2DRD3DRD5SIGMAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220387403-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING NASH, NAFLD, AND OBESITY CVI PHARMACEUTICALS LIMITED (KY) 2022-12-08 US disclosed
US-20220387403-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING NASH, NAFLD, AND OBESITY CVI PHARMACEUTICALS LIMITED (KY) 2022-12-08 US disclosed
WO-2021067490-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING NASH, NAFLD, AND OBESITY CVI PHARMACEUTICALS LIMITED (KY) 2021-04-08 WO disclosed
US-20170100389-A1 TETRAHYDROPROTOBERBINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND NEURODEGENERATIVE DISEASES MILLER JAMES JACKSON (CA) 2017-04-13 US disclosed
US-9526721-B2 Tetrahydroprotoberbine compounds and uses thereof in the treatment of neurological, psychiatric and neurodegenerative diseases MILLER JAMES JACKSON (CA) 2016-12-27 US disclosed
US-20150306092-A1 TETRAHYDROPROTOBERBINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND NEURODEGENERATIVE DISEASES MILLER JAMES JACKSON (CA) 2015-10-29 US disclosed
US-8815900-B2 Compounds and compositions for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2014-08-26 US disclosed
US-8815900-B2 Compounds and compositions for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2014-08-26 US disclosed
US-8710071-B2 Compounds, compositions and methods for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2014-04-29 US disclosed
US-8710071-B2 Compounds, compositions and methods for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2014-04-29 US disclosed
US-20110269754-A1 COMPOUNDS AND COMPOSITIONS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2011-11-03 US disclosed
US-8003795-B2 Compounds and compositions for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2011-08-23 US disclosed
US-8003795-B2 Compounds and compositions for reducing lipid levels CVI PHARMACEUTICALS LIMITED (KY) 2011-08-23 US disclosed
US-20110009628-A1 Compounds and Compositions for Modulating Lipid Levels and Methods of Preparing Same CVI PHARMACEUTICALS LIMITED (KY) 2011-01-13 US disclosed
US-20110009628-A1 Compounds and Compositions for Modulating Lipid Levels and Methods of Preparing Same CVI PHARMACEUTICALS LIMITED (KY) 2011-01-13 US disclosed
WO-2011006000-A1 BERBERINE DERIVATIVES USEFUL FOR MODULATING LIPID LEVELS AND THEIR METHODS OF SYNTHESIS LIU HAIYAN (US) 2011-01-13 WO disclosed
WO-2010075469-A1 CORYDALINE DERIVATIVES USEFUL FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2010-07-01 WO disclosed
US-20090048246-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2009-02-19 US disclosed
US-20090048246-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2009-02-19 US disclosed
WO-2009002873-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2008-12-31 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 (6 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-20110009628-A1 Compounds and Compositions for Modulating Lipid Levels and Methods of Preparing Same LIPC, LDLR, PCSK9 DRD1 4873/4885DRD2 4863/4885DRD3 4832/4885
US-20220387403-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING NASH, NAFLD, AND OBESITY LIPC, FABP1, CPT1A DRD1 4727/4885DRD2 4557/4885DRD3 4182/4885
US-20170100389-A1 TETRAHYDROPROTOBERBINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND NEURODEGENERATIVE DISEASES HTR1B, HTR2B, MAOB DRD1 124/4885DRD2 63/4885DRD3 258/4885
US-20110269754-A1 COMPOUNDS AND COMPOSITIONS FOR REDUCING LIPID LEVELS LIPC, LIPE, BCHE DRD1 465/4885DRD2 139/4885DRD3 532/4885
US-20150306092-A1 TETRAHYDROPROTOBERBINE COMPOUNDS AND USES THEREOF IN THE TREATMENT OF NEUROLOGICAL, PSYCHIATRIC AND NEURODEGENERATIVE DISEASES HTR1B, HTR2B, MAOB DRD1 119/4885DRD2 64/4885DRD3 259/4885
US-20090048246-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS LIPC, BCHE, LIPE DRD1 553/4885DRD2 175/4885DRD3 613/4885

“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.