⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1974906 | 0.85 | — | — | |
| SCHEMBL7854010 | 0.79 | ALDH1A1 (0.32) | — | |
| SCHEMBL10620311 | 0.77 | TRPA1 (0.33) | — | |
| SCHEMBL9277989 | 0.67 | — | — | |
| SCHEMBL7845968 | 0.65 | PTGS1 (0.32) | — | |
| SCHEMBL10816075 | 0.64 | — | — | |
| SCHEMBL3424768 | 0.64 | — | — | |
| SCHEMBL10599168 | 0.62 | CA1 (0.35) | — | |
| SCHEMBL3368476 | 0.61 | — | — | |
| SCHEMBL5691105 | 0.61 | — | — |
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 29 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4729839-A | THIO ESTER-ETHERS, ESTERIFICATION, ETHERIFICATION | PHILLIPS PETROLEUM COMPANY (US) | 1988-03-08 | — | — | US | claimed |
| EP-0249783-A1 | Water soluble lubricating additives | PHILLIPS PETROLEUM COMPANY (US) | 1987-12-23 | — | — | EP | claimed |
| EP-0686613-B1 | OZONIDE REDUCING AGENT | OTSUKA KAGAKU KK (JP) | 2001-11-14 | — | — | EP | disclosed |
| US-5770729-A | SULFIDE COMPOUND WITH POLAR SUBSTITUENTS, FORMATION OF SULFOXIDE, MILD CONDITIONS, SAFE, NONPOLLUTING | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1998-06-23 | — | — | US | disclosed |
| EP-0686613-A1 | OZONIDE REDUCING AGENT | OTSUKA KAGAKU KABUSHIKI KAISHA (JP) | 1995-12-13 | — | — | EP | disclosed |
| EP-0546269-B1 | Pigment preparations | BASF LACKE & FARBEN (DE) | 1995-05-10 | — | — | EP | disclosed |
| WO-1993017072-A1 | USE OF ETHERS AND/OR ESTERS OF DI(HYDROXYALKYL)SULPHONES AS PROCESSING ADDITIVES FOR THERMOPLASTIC SYNTHETIC MATERIALS | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1993-09-02 | — | — | WO | disclosed |
| EP-0546269-A1 | Pigment preparations | BASF Lacke + Farben AG (DE) | 1993-06-16 | — | — | EP | disclosed |
| EP-0165503-B1 | PROCESS FOR THE REMOVAL OF ACID GASES FROM A GAS MIXTURE | UNION CARBIDE CORPORATION (US) | 1989-09-06 | — | — | EP | disclosed |
| US-4729839-A | THIO ESTER-ETHERS, ESTERIFICATION, ETHERIFICATION | PHILLIPS PETROLEUM COMPANY (US) | 1988-03-08 | — | — | US | disclosed |
| EP-0249783-A1 | Water soluble lubricating additives | PHILLIPS PETROLEUM COMPANY (US) | 1987-12-23 | — | — | EP | disclosed |
| US-4256591-A | AN ADDUCT OR ORGANIC SALT OF MELAMINE AND (ISO)CYANURIC ACID; EXTREME PRESSURE AND TEMPERATURE; METAL WORKING | MITSUBISHI PETROCHEMICAL CO., LTD. (JP) | 1981-03-17 | — | — | US | disclosed |
| US-4253918-A | FOR PAPER SUBSTRATES | PFIZER INC. (US) | 1981-03-03 | — | — | US | disclosed |
| EP-0009216-A2 | Dry photoresist sheet composition and storable, dry, non-reticulated photopolymerizable photoresist sheet | BAYER AG (DE) | 1980-04-02 | — | — | EP | disclosed |
| EP-0008787-A1 | Binder for an electron beam positive resisting lacquer | BAYER AG (DE) | 1980-03-19 | — | — | EP | disclosed |
| US-4179478-A | Process for the production of binders | BAYER AKTIENGESELLSCHAFT (DE) | 1979-12-18 | — | — | US | disclosed |
| EP-0003483-A2 | Photocurable resins with photoinitiator and accelerator incorporated therein and their use in UV-hardenable film forming compositions | BAYER AG (DE) | 1979-08-22 | — | — | EP | disclosed |
| US-4162274-A | Crosslinkable urethane resins containing vinyl and carboxyl groups | BAYER AKTIENGESELLSCHAFT (DE) | 1979-07-24 | — | — | US | disclosed |
| US-4081492-A | POLYEPOXIDE BINDERS | BAYER AKTIENGESELLSCHAFT (DT) | 1978-03-28 | — | — | US | disclosed |
| US-4049745-A | REACTION PRODUCT OF POLYEPOXIDE AND AN ACRYLIC ACID | BAYER AKTIENGESELLSCHAFT (DT) | 1977-09-20 | — | — | US | disclosed |