SCHEMBL909976

SCHEMBL909976

COC(=O)c1cc2c(cc1OC)CCN1Cc3c(ccc(OC)c3OS(=O)(=O)c3cccc(F)c3)C(C)C21

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAOB P27338 1/20 0.54
SCN5A Q14524 1/20 0.43
SCN9A Q15858 1/20 0.43
LMNA P02545 2/20 0.40
TSHR P16473 1/20 0.39
DRD1 P21728 10/20 0.38
DRD2 P14416 8/20 0.38
F3 P13726 7/20 0.38
DRD3 P35462 4/20 0.38
DRD5 P21918 3/20 0.38
SIGMAR1 Q99720 2/20 0.38
CYP3A4 P08684 1/20 0.38
P2RX7 Q99572 1/20 0.38
DRD4 P21917 1/20 0.38

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
SCHEMBL30000063 1.00 MAOB (0.54) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL910022 0.89 DRD1 (0.52) LMNATSHRDRD1DRD2F3
SCHEMBL29999220 0.89 DRD1 (0.52) LMNATSHRDRD1DRD2F3
SCHEMBL910873 0.88 MAOB (0.58) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL29999161 0.88 MAOB (0.58) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL910911 0.87 MAOB (0.54) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL30000276 0.87 MAOB (0.54) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL910498 0.83 MAOB (0.56) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL30000403 0.83 MAOB (0.56) MAOBSCN5ASCN9ALMNATSHR
SCHEMBL910446 0.82 MAOB (0.71) MAOBLMNATSHRDRD1DRD2

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 10 patents. 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
EP-2370434-B1 ISOQUINOLINYL-CONTAINING ALKALOID COMPOUNDS AND COMPOSITIONS USEFUL FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LTD (KY) 2014-09-17 EP 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-20120004223-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2012-01-05 US disclosed
US-20120004223-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS CVI PHARMACEUTICALS LIMITED (KY) 2012-01-05 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
US-20110009628-A1 Compounds and Compositions for Modulating Lipid Levels and Methods of Preparing Same CVI PHARMACEUTICALS LIMITED (KY) 2011-01-13 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 (3 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 MAOB 2239/4885SCN5A 4070/4885SCN9A 4229/4885
US-20220387403-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR TREATING NASH, NAFLD, AND OBESITY LIPC, FABP1, CPT1A MAOB 1008/4885SCN5A 3780/4885SCN9A 4097/4885
US-20120004223-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR REDUCING LIPID LEVELS LIPC, LDLR, PCSK9 MAOB 1600/4885SCN5A 3810/4885SCN9A 3800/4885

“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.