⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL904712 | 1.00 | — | — | |
| SCHEMBL10013294 | 0.87 | ALDH1A1 (0.44) | — | |
| SCHEMBL181866 | 0.87 | ALDH1A1 (0.44) | — | |
| SCHEMBL181867 | 0.87 | ALDH1A1 (0.44) | — | |
| SCHEMBL11795470 | 0.77 | — | — | |
| SCHEMBL11795466 | 0.77 | — | — | |
| SCHEMBL9409005 | 0.74 | — | — | |
| SCHEMBL9409006 | 0.74 | — | — | |
| Dimethylamine SCHEMBL28581196 | 0.74 | FFAR3 (0.33) | — | |
| SCHEMBL17509818 | 0.73 | — | — |
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 77 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116891459-A | Synthesis method of polysubstituted triazinane compound | 湖北九康通生物医药有限公司 | 2023-10-17 | — | — | CN | claimed |
| WO-2023193818-A1 | METHOD FOR SYNTHESIZING POLYSUBSTITUTED TRIAZINE COMPOUND | 湖北九康通生物医药有限公司 | 2023-10-12 | — | — | WO | claimed |
| CN-110950839-B | Preparation method of 4- (4-halo-1H-pyrazol-1-yl) piperidine-1-carboxylic acid tert-butyl ester | 蚌埠中实化学技术有限公司 | 2023-04-14 | — | — | CN | claimed |
| CN-108084078-B | Synthesis method of medicine apremilast for treating psoriatic arthritis diseases | 中山大学 | 2021-07-30 | — | — | CN | claimed |
| CN-110950839-A | Preparation method of 4- (4-halo-1H-pyrazol-1-yl) piperidine-1-carboxylic acid tert-butyl ester | 蚌埠中实化学技术有限公司 | 2020-04-03 | — | — | CN | claimed |
| US-20040249147-A1 | Synthesis of key azole-antifungal intermediates | RANBAXY LABORATORIES LIMITED (IN) | 2004-12-09 | — | — | US | claimed |
| EP-1432704-A1 | SYNTHESIS OF KEY AZOLE-ANTIFUNGAL INTERMEDIATES | RANBAXY LABORATORIES, LTD. (IN) | 2004-06-30 | — | — | EP | claimed |
| EP-0922046-B1 | PROCESS FOR THE PREPARATION OF 7-ALKOXYALKYL-1,2,4-TRIAZOLO 1,5-A] PYRIMIDINE DERIVATIVES | ABBOTT GMBH & CO KG (DE) | 2004-04-28 | — | — | EP | claimed |
| WO-2003027103-A1 | SYNTHESIS OF KEY AZOLE-ANTIFUNGAL INTERMEDIATES | RANBAXY LABORATORIES LIMITED (IN) | 2003-04-03 | — | — | WO | claimed |
| EP-0922046-A1 | PROCESS FOR THE PREPARATION OF 7-ALKOXYALKYL-1,2,4-TRIAZOLO 1,5-A] PYRIMIDINE DERIVATIVES | KNOLL AKTIENGESELLSCHAFT (DE) | 1999-06-16 | — | — | EP | claimed |
| WO-1998007724-A1 | PROCESS FOR THE PREPARATION OF 7-ALKOXYALKYL-1,2,4-TRIAZOLO[1,5-A] PYRIMIDINE DERIVATIVES | KNOLL AKTIENGESELLSCHAFT (DE) | 1998-02-26 | — | — | WO | claimed |
| US-5539102-A | ANTIBIOTIC SYNTHESIS BY DEHYDRATION REACTION OF ALCOHOL WITH OXYCARBONYLSULFAMIDE IN THE PRESENCE OF TRIVALENT PHOSPHOROUS | SHIONOGI SEIYAKU KABUSHIKI KAISHA (JP) | 1996-07-23 | — | — | US | claimed |
| JP-6072986-A | — | — | None | — | — | JP | disclosed |
| CN-114616332-B | GalNAc-oligonucleotide conjugate for delivery to liver and preparation method thereof | 第一三共株式会社 | 2024-09-20 | — | — | CN | disclosed |
| CN-116891459-A | Synthesis method of polysubstituted triazinane compound | 湖北九康通生物医药有限公司 | 2023-10-17 | — | — | CN | disclosed |
| WO-2023193818-A1 | METHOD FOR SYNTHESIZING POLYSUBSTITUTED TRIAZINE COMPOUND | 湖北九康通生物医药有限公司 | 2023-10-12 | — | — | WO | disclosed |
| US-4282342-A | Preparation of terpolymers | BASF AKTIENGESELLSCHAFT (DE) | 1981-08-04 | — | — | US | disclosed |
| US-4250289-A | USING A POLY(ALKYL VINYL ETHER) AS A DISPERSANT IN SUSPENSION POLYMERIZATION | BASF AKTIENGESELLSCHAFT (DE) | 1981-02-10 | — | — | US | disclosed |
| US-4067866-A | Process for preparing cephalosporins and certain novel 2β-thiohydrazo-azetidinones as intermediates | SOCIETA' FARMACEUTICI ITALIA (IT) | 1978-01-10 | — | — | US | disclosed |
| US-4036835-A | Process for preparing cephalosporins | SOCIETA' FARMACEUTICI ITALIA (IT) | 1977-07-19 | — | — | US | disclosed |