SCHEMBL1496432

SCHEMBL1496432

OB(O)c1ccc(F)c(OC(F)(F)F)c1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
MGLL Q99685 2/20 0.39
EPHX2 P34913 1/20 0.39
ABL1 P00519 1/20 0.37
PDE2A O00408 1/20 0.36
IDO1 P14902 2/20 0.36
TDO2 P48775 1/20 0.36
ENPP2 Q13822 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
TTR P02766 1/20 0.34
KCNN4 O15554 2/20 0.34

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
SCHEMBL31437950 1.00 MGLL (0.39) MGLLEPHX2ABL1PDE2AIDO1
SCHEMBL491621 0.85 EPHX2 (0.50) MGLLEPHX2ABL1PDE2ACA1
SCHEMBL22683815 0.81 APP (0.45) MGLLABL1ENPP2CA1CA2
SCHEMBL29952898 0.81 APP (0.45) MGLLABL1ENPP2CA1CA2
SCHEMBL29953617 0.80 MGLL (0.38) MGLLEPHX2ABL1PDE2AENPP2
SCHEMBL29955486 0.80 TTR (0.42) MGLLABL1ENPP2CA1CA2
SCHEMBL2409490 0.80 TTR (0.42) MGLLABL1ENPP2CA1CA2
SCHEMBL20638904 0.79 ENPP2 (0.41) MGLLABL1PDE2AENPP2CA1
SCHEMBL29953216 0.79 ENPP2 (0.41) MGLLABL1PDE2AENPP2CA1
SCHEMBL29953648 0.78 MGLL (0.39) MGLLEPHX2ABL1PDE2AENPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11702401-B2 Compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2023-07-18 US disclosed
US-20220000847-A1 Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC (US) 2022-01-06 US disclosed
US-11053216-B2 Compounds and methods of use MEDIVATION TECHNOLOGIES LLC (US) 2021-07-06 US disclosed
CN-107531705-B Bicyclic ketone sulfonamide compounds 美国安进公司 2020-09-18 CN disclosed
EP-3089971-B1 COMPOUNDS AND METHODS OF USE MEDIVATION TECH LLC (US) 2020-07-29 EP disclosed
US-10668067-B2 Pyridine sulfonamides AMGEN INC. (US) 2020-06-02 US disclosed
US-10668067-B2 Pyridine sulfonamides AMGEN INC. (US) 2020-06-02 US disclosed
US-20200071296-A1 Compounds and Methods of Use MEDIVATION TECHNOLOGIES LLC 2020-03-05 US disclosed
US-20190167682-A1 PYRIDINE SULFONAMIDES AMGEN INC. (US) 2019-06-06 US disclosed
US-20190167682-A1 PYRIDINE SULFONAMIDES AMGEN INC. (US) 2019-06-06 US disclosed
EP-2483290-A1 CYCLIC PEPTIDE INHIBITORS OF HEPATITIS C VIRUS REPLICATION Intermune, Inc. (US) 2012-08-08 EP disclosed
US-20110218192-A1 Inhibitors Of Beta-Secretase VITAE PHARMACEUTICALS, INC. (US) 2011-09-08 US disclosed
US-20110218192-A1 Inhibitors Of Beta-Secretase VITAE PHARMACEUTICALS, INC. (US) 2011-09-08 US disclosed
EP-2324032-A2 INHIBITORS OF BETA-SECRETASE Vitae Pharmaceuticals, Inc. (US) 2011-05-25 EP disclosed
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-04-07 US disclosed
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-04-07 US disclosed
WO-2011038293-A1 CYCLIC PEPTIDE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-03-31 WO disclosed
WO-2011038293-A1 CYCLIC PEPTIDE INHIBITORS OF HEPATITIS C VIRUS REPLICATION INTERMUNE, INC. (US) 2011-03-31 WO disclosed
WO-2010021680-A2 INHIBITORS OF BETA-SECRETASE VITAE PHARMACEUTICALS, INC. (US) 2010-02-25 WO disclosed
WO-2010021680-A2 INHIBITORS OF BETA-SECRETASE VITAE PHARMACEUTICALS, INC. (US) 2010-02-25 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 (8 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-20110218192-A1 Inhibitors Of Beta-Secretase BACE1, BACE2, APP MGLL 1603/4885EPHX2 1305/4885ABL1 3137/4885
US-20220000847-A1 Compounds and Methods of Use TGFB2, TGFB1, HDGF MGLL 3064/4885EPHX2 1597/4885ABL1 1120/4885
US-11702401-B2 Compounds and methods of use TGFB2, TGFB1, HDGF MGLL 3064/4885EPHX2 1597/4885ABL1 1120/4885
US-20190167682-A1 PYRIDINE SULFONAMIDES TRPV1, TRPA1, TRPV5 MGLL 4282/4885EPHX2 3456/4885ABL1 259/4885
US-20200071296-A1 Compounds and Methods of Use TGFB2, TGFB1, HDGF MGLL 3064/4885EPHX2 1597/4885ABL1 1120/4885
US-10668067-B2 Pyridine sulfonamides TRPV1, TRPA1, TRPV5 MGLL 4282/4885EPHX2 3456/4885ABL1 259/4885
US-11053216-B2 Compounds and methods of use TGFB2, TGFB1, HDGF MGLL 3064/4885EPHX2 1597/4885ABL1 1120/4885
US-20110081315-A1 NOVEL MACROCYCLIC INHIBITORS OF HEPATITIS C VIRUS REPLICATION EIF2AK2, HAVCR2, EIF4A2 MGLL 3415/4885EPHX2 1977/4885ABL1 642/4885

“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.