⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL30480966 | 1.00 | — | — | |
| SCHEMBL93619 | 1.00 | — | — | |
| SCHEMBL455427 | 1.00 | — | — | |
| Bromide SCHEMBL28229434 | 0.98 | NPC1 (0.68) | — | |
| Hydrochloric Acid SCHEMBL4201176 | 0.98 | NPC1 (0.68) | — | |
| Iodide SCHEMBL28203943 | 0.98 | NPC1 (0.68) | — | |
| Styrene SCHEMBL8437178 | 0.84 | NPC1 (0.52) | — | |
| Methyl Alcohol SCHEMBL28478479 | 0.84 | NPC1 (0.89) | — | |
| SCHEMBL2631576 | 0.84 | NPC1 (0.62) | — | |
| SCHEMBL229329 | 0.84 | NPC1 (1.00) | — |
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-4141915-A | REACTING AN UNSATURATED NITRILE, AN ALCOHOL, AND CARBON MONOXIDE | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) | 1979-02-27 | — | — | US | claimed |
| CN-108179235-B | Tanning agent prepared from modified rice dialdehyde starch | 温州大学 | 2020-09-29 | — | — | CN | disclosed |
| EP-3313837-B1 | CARBOLINE ANTIPARASITICS | ZOETIS SERVICES LLC (US) | 2020-09-09 | — | — | EP | disclosed |
| EP-2390243-B1 | PROCESS FOR PREPARING BISPHENOL | MITSUBISHI CHEM CORP (JP) | 2020-07-08 | — | — | EP | disclosed |
| US-10570129-B2 | Carboline antiparasitics | ZOETIS SERVICES LLC (US) | 2020-02-25 | — | — | US | disclosed |
| US-20200031822-A1 | CARBOLINE ANTIPARASITICS | ZOETIS SERVICES LLC (US) | 2020-01-30 | — | — | US | disclosed |
| EP-3313837-A1 | CARBOLINE ANTIPARASITICS | Zoetis Services LLC (US) | 2018-05-02 | — | — | EP | disclosed |
| WO-2016209635-A1 | CARBOLINE ANTIPARASITICS | ZOETIS SERVICES LLC (US) | 2016-12-29 | — | — | WO | disclosed |
| EP-1891042-B1 | 2-OXO-1-PYRROLIDINE DERIVATIVES, PROCESSES FOR PREPARING THEM AND THEIR THERAPEUTIC USE ON THE CENTRAL NERVOUS SYSTEM | UCB PHARMA SA (BE) | 2013-10-02 | — | — | EP | disclosed |
| US-8445731-B2 | Process for producing bisphenol compound | MITSUBISHI CHEMICAL CORPORATION (JP) | 2013-05-21 | — | — | US | disclosed |
| EP-0944563-B1 | SUBSTANCE MIXTURES CONTAINING STABILIZERS AND COMPOUNDS CONTAINING VINYL GROUPS | BASF AG (DE) | 2002-04-03 | — | — | EP | disclosed |
| US-6200460-B1 | MIXTURE COMPRISING VINYL AROMATIC COMPOUND, ACTIVE AMOUNT OF MIXTURE WHICH INHIBITS THE PREMATURE POLYMERIZATION OF SAID COMPOUND COMPRISING NOXYL COMPOUND, IRON COMPOUND, OPTIONALLY NITRO COMPOUNDS AND COSTABILIZERS | BASF AKTIENGESELLSCHAFT (DE) | 2001-03-13 | — | — | US | disclosed |
| US-6143205-A | A MIXTRUE COMPRISES A VINYL-CONTAINING MONOMERS, AND A MIXTURE OF PREMATURE POLYMERIZATION INHIBITOR OF MONOMERS DURING PURIFICATION OR DISTILLATION COMPRISING A N-OXYL COMPOUND OF SECONDARY AMINE AND A NITRO COMPOUND | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-07 | — | — | US | disclosed |
| US-4972000-A | MULTILAYER, CROSSLINKED PARTICLES FOR COATING COMPOSITIONS | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1990-11-20 | — | — | US | disclosed |
| EP-0331421-A2 | Hollow polymer particles, process for production thereof, and use thereof as pigment | JAPAN SYNTHETIC RUBBER CO., LTD. (JP) | 1989-09-06 | — | — | EP | disclosed |
| EP-0015385-B1 | PROCESS FOR THE PREPARATION OF N-PROPYL- AND N-ETHYLCYANOACETIC ACID ESTERS | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1982-05-12 | — | — | EP | disclosed |
| EP-0015385-A1 | Process for the preparation of n-propyl- and n-ethylcyanoacetic acid esters | HÜLS TROISDORF AKTIENGESELLSCHAFT (DE) | 1980-09-17 | — | — | EP | disclosed |
| US-4212978-A | Process for the catalytic production of 2-substituted pyridines | LONZA LTD. (CH) | 1980-07-15 | — | — | US | disclosed |
| US-4196287-A | Process for the catalytic production of 2-substituted pyridines | LONZA LTD. (CH) | 1980-04-01 | — | — | US | disclosed |
| US-4141915-A | REACTING AN UNSATURATED NITRILE, AN ALCOHOL, AND CARBON MONOXIDE | DYNAMIT NOBEL AKTIENGESELLSCHAFT (DE) | 1979-02-27 | — | — | US | disclosed |