⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL10074752 | 0.87 | — | — | |
| SCHEMBL7428860 | 0.77 | — | — | |
| SCHEMBL11173433 | 0.76 | — | — | |
| SCHEMBL9670422 | 0.73 | — | — | |
| SCHEMBL17147559 | 0.73 | — | — | |
| SCHEMBL9677995 | 0.73 | CYP1A2 (0.41) | — | |
| SCHEMBL8047846 | 0.71 | ALDH1A1 (0.38) | — | |
| SCHEMBL3093072 | 0.71 | CA1 (0.31) | — | |
| SCHEMBL8119478 | 0.69 | — | — | |
| SCHEMBL28204173 | 0.69 | — | — |
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 50 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6036888-A | ADDING SULFUR-CONTAINING HETEROCYCLIC RING COMPOUNDS TO AQUEOUS ALKANOLAMINE SOLUTION TO INHIBIT CORROSION OF METALS IN ACID GAS RICH AND ACID GAS LEAN PORTIONS OF AN ACID GAS REMOVAL UNIT | BETZDEARBORN INC. (US) | 2000-03-14 | — | — | US | claimed |
| US-5994270-A | CONTROLLING GAEUMANNOMYCES | MONSANTO COMPANY (US) | 1999-11-30 | — | — | US | claimed |
| WO-1999010561-A1 | CORROSION INHIBITOR FOR ALKANOLAMINE UNITS | BETZDEARBORN INC. (US) | 1999-03-04 | — | — | WO | claimed |
| US-20210163473-A1 | FLUORINATED INTEGRIN ANTAGONISTS | FELIQS CORPORATION (JP) | 2021-06-03 | — | — | US | disclosed |
| WO-2020159447-A1 | METHOD OF SYNTHESIZING SINGLE-STRANDED NUCLEOTIDE SEQUENCE, BLOCKED NUCLEOSIDE TRIPHOSPHATES AND RELATED METHODS | AGENCY FOR SCIENCE, TECHNOLOGY AND RESEARCH (SG) | 2020-08-06 | — | — | WO | disclosed |
| US-20190263810-A1 | FLUORINATED INTEGRIN ANTAGONISTS | FELIQS CORPORATION (JP) | 2019-08-29 | — | — | US | disclosed |
| CN-108586705-A | xylylene diisocyanate composition having improved stability and reactivity and optical lens using the same | SKC株式会社 | 2018-09-28 | — | — | CN | disclosed |
| US-20180016276-A1 | FLUORINATED 3-(2-OXO-3-(3-ARYLPROPYL)IMIDAZOLIDIN-1-YL)-3-ARYLPROPANOIC ACID DERIVATIVES | FELIQS CORPORATION (JP) | 2018-01-18 | — | — | US | disclosed |
| US-20170291900-A1 | FLUORINATED INTEGRIN ANTAGONISTS | FELIQS CORPORATION (JP) | 2017-10-12 | — | — | US | disclosed |
| US-9758688-B2 | Composition for forming conductive film | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2017-09-12 | — | — | US | disclosed |
| US-9717729-B2 | Fluorinated integrin antagonists | SCIFLUOR LIFE SCIENCES, INC. (US) | 2017-08-01 | — | — | US | disclosed |
| US-6036888-A | ADDING SULFUR-CONTAINING HETEROCYCLIC RING COMPOUNDS TO AQUEOUS ALKANOLAMINE SOLUTION TO INHIBIT CORROSION OF METALS IN ACID GAS RICH AND ACID GAS LEAN PORTIONS OF AN ACID GAS REMOVAL UNIT | BETZDEARBORN INC. (US) | 2000-03-14 | — | — | US | disclosed |
| EP-0901486-A1 | NOVEL (THIO)(METH)ACRYLATE MONOMERS, INTERMEDIATE COMPOUNDS FOR THE SYNTHESIS OF THESE MONOMERS, POLYMERISABLE COMPOSITIONS AND RESULTING POLYMERS AND OPTICAL AND OPHTHALMOLOGIC APPLICATIONS THEREOF | ESSILOR INTERNATIONAL COMPAGNIE GENERALE D'OPTIQUE (FR) | 1999-03-17 | — | — | EP | disclosed |
| WO-1999010561-A1 | CORROSION INHIBITOR FOR ALKANOLAMINE UNITS | BETZDEARBORN INC. (US) | 1999-03-04 | — | — | WO | disclosed |
| WO-1998035955-A1 | NOVEL (THIO)(METH)ACRYLATE MONOMERS, INTERMEDIATE COMPOUNDS FOR THE SYNTHESIS OF THESE MONOMERS, POLYMERISABLE COMPOSITIONS AND RESULTING POLYMERS AND OPTICAL AND OPHTHALMOLOGIC APPLICATIONS THEREOF | ESSILOR INTERNATIONAL - COMPAGNIE GENERALE D'OPTIQUE (FR) | 1998-08-20 | — | — | WO | disclosed |
| US-4699652-A | Fungicidal pyridine derivatives for use in agriculture | HOFFMANN-LA ROCHE INC. (US) | 1987-10-13 | — | — | US | disclosed |
| EP-0209854-A2 | Pyridine derivatives and their use as fungicidal agents | F. HOFFMANN-LA ROCHE & CO. Aktiengesellschaft (CH) | 1987-01-28 | — | — | EP | disclosed |
| EP-0035228-B1 | TETRAZOLE DERIVATIVES, PROCESS FOR THE PREPARATION THEREOF, AND ANTI-ULCER COMPOSITION CONTAINING THE SAME | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1985-01-02 | — | — | EP | disclosed |
| US-4372953-A | Tetrazole derivatives, and anti-ulcer composition containing the same | OTSUKA PHARMACEUTICAL COMPANY, LIMITED (JP) | 1983-02-08 | — | — | US | disclosed |
| EP-0035228-A1 | Tetrazole derivatives, process for the preparation thereof, and anti-ulcer composition containing the same | OTSUKA PHARMACEUTICAL CO., LTD. (JP) | 1981-09-09 | — | — | EP | disclosed |