SCHEMBL5597294

SCHEMBL5597294

COc1ccc(NC=O)c(C)c1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.53
OR51E2 Q9H255 1/20 0.49
RAB9A P51151 2/20 0.47
ADRA2A P08913 1/20 0.46
ADRA2C P18825 1/20 0.46
ADRA1D P25100 1/20 0.46
ADRA1A P35348 1/20 0.46
ADRA1B P35368 1/20 0.46
HTT P42858 1/20 0.45
FFAR4 Q5NUL3 1/20 0.43
CA12 O43570 2/20 0.43
CA1 P00915 2/20 0.43
CA2 P00918 2/20 0.43
CA9 Q16790 2/20 0.43
MEN1 O00255 1/20 0.42
KMT2A Q03164 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
NPC1 O15118 1/20 0.41

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
SCHEMBL1911389 0.85 OR51E2 (0.46) GAAOR51E2HTTMEN1KMT2A
SCHEMBL2203559 0.81 ALDH1A1 (0.56) GAAOR51E2RAB9AHTTCA12
SCHEMBL14216549 0.81 GAA (0.53) GAARAB9AADRA2AADRA2CADRA1D
SCHEMBL5223370 0.80 ERN1 (0.56) OR51E2RAB9AHTTALDH1A1MAPT
SCHEMBL31432473 0.80 TRIM24 (0.56) GAAOR51E2RAB9AADRA1AMEN1
SCHEMBL2095308 0.80 OR51E2 (0.48) GAAOR51E2RAB9AHTTMEN1
SCHEMBL9947244 0.79 OR51E2 (0.50) OR51E2ADRA1AHTTKMT2AALDH1A1
SCHEMBL1758614 0.78 ALDH1A1 (0.56) GAAOR51E2RAB9AHTTCA12
SCHEMBL19390278 0.77 GAA (0.49) GAARAB9AADRA2AADRA2CADRA1D
SCHEMBL1188765 0.76 OR51E2 (0.45) GAAOR51E2RAB9AHTTMEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7211202-B2 Process to make a conductive composition of a fluorinated polymer which contains polyaniline ATOFINA (FR) 2007-05-01 US claimed
EP-1428857-B1 Process to make a conductive composition of a fluorinated polymer which contains polyaniline ARKEMA FRANCE (FR) 2007-01-31 EP claimed
EP-1189891-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION Bioscience AG (DE) 2002-03-27 EP claimed
US-6362342-B1 BIOSYNTHESIS; DRUG LIBRARIES LION BIOSCIENCE AG (DE) 2002-03-26 US claimed
WO-2001000594-A1 TRIAZOLE COMPOUNDS AND COMBINATORIAL LIBRARIES THEREOF LION BIOSCIENCE AG (DE) 2001-01-04 WO claimed
CN-119751280-A Preparation method of 2-methyl-4-methoxy diphenylamine 河北建新化工股份有限公司 2025-04-04 CN disclosed
US-11111252-B2 Pyrimidine compounds and pyrimido indole compounds and methods of use DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2021-09-07 US disclosed
US-11001595-B2 Pyrimidine compounds and pyrimido indole compounds and methods of use DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2021-05-11 US disclosed
US-20200369681-A1 PYRIMIDINE COMPOUNDS AND PYRIMIDO INDOLE COMPOUNDS AND METHODS OF USE DUQUESNE UNIVERSITY OF THE HOLY SPIRIT 2020-11-26 US disclosed
US-20200369680-A1 PYRIMIDINE COMPOUNDS AND PYRIMIDO INDOLE COMPOUNDS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2020-11-26 US disclosed
US-10774090-B2 Pyrimidine compounds and pyrimido indole compounds and methods of use DUQUESNE UNIVERSITY OF THE HOLY SPIRIT (US) 2020-09-15 US disclosed
US-20190233432-A1 PYRIMIDINE COMPOUNDS AND PYRIMIDO INDOLE COMPOUNDS AND METHODS OF USE NATIONAL INSTITUTES OF HEALTH (NIH), U.S. DEPT. OF HEALTH AND HUMAN SERVICES (DHHS), U.S. GOVERNMENT 2019-08-01 US disclosed
WO-1998032805-A1 COATING COMPOSITION, METHOD FOR THE PREPARATION THEREOF AND USE THEREOF IN ANTICORROSIVE PAINT DSM N.V. (NL) 1998-07-30 WO disclosed
WO-1998031754-A1 RADIATION CURABLE CONDUCTIVE COATING DISPERSION, PROCESS FOR ITS PREPARATION AND COATINGS MADE OF IT DSM N.V. (NL) 1998-07-23 WO disclosed
EP-0821040-A1 Aqueous coating dispersion, process for the preparation thereof and use thereof in anticorrosive paint DSM N.V. (NL) 1998-01-28 EP disclosed
EP-0821041-A2 Aqueous coating dispersion, process for the preparation thereof and use thereof in anticorrosive paint DSM N.V. (NL) 1998-01-28 EP disclosed
EP-0538939-B1 Polymer composition DSM NV (NL) 1996-06-19 EP disclosed
EP-0589529-A1 Dispersion of electrically conductive particles in a dispersing medium DSM N.V. (NL) 1994-03-30 EP disclosed
US-5262483-A Styrene-maleic anhydride and polyaniline grafted with processability and conductivity DSM N.V. (NL) 1993-11-16 US disclosed
EP-0538939-A1 Polymer composition DSM N.V. (NL) 1993-04-28 EP 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-20200369680-A1 PYRIMIDINE COMPOUNDS AND PYRIMIDO INDOLE COMPOUNDS AND METHODS OF USE DPYD, HPRT1, TPMT GAA 3776/4885OR51E2 3727/4885RAB9A 1463/4885
US-20200369681-A1 PYRIMIDINE COMPOUNDS AND PYRIMIDO INDOLE COMPOUNDS AND METHODS OF USE DPYD, TYMP, TPMT GAA 2163/4885OR51E2 4362/4885RAB9A 2270/4885
US-20190233432-A1 PYRIMIDINE COMPOUNDS AND PYRIMIDO INDOLE COMPOUNDS AND METHODS OF USE DPYD, HPRT1, TPMT GAA 3763/4885OR51E2 3729/4885RAB9A 1420/4885
US-10774090-B2 Pyrimidine compounds and pyrimido indole compounds and methods of use DPYD, HPRT1, TPMT GAA 3763/4885OR51E2 3729/4885RAB9A 1420/4885
US-11111252-B2 Pyrimidine compounds and pyrimido indole compounds and methods of use DPYD, TYMP, TPMT GAA 2163/4885OR51E2 4362/4885RAB9A 2270/4885
US-11001595-B2 Pyrimidine compounds and pyrimido indole compounds and methods of use DPYD, HPRT1, TPMT GAA 3776/4885OR51E2 3727/4885RAB9A 1463/4885

“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.