⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29187645 | 0.97 | CA1 (0.35) | — | |
| SCHEMBL30609026 | 0.79 | — | — | |
| SCHEMBL27499064 | 0.77 | CA1 (0.31) | — | |
| SCHEMBL5536943 | 0.75 | CA1 (0.33) | — | |
| SCHEMBL758884 | 0.72 | CA2 (0.41) | — | |
| SCHEMBL160 | 0.72 | CA2 (0.41) | — | |
| SCHEMBL758883 | 0.72 | CA2 (0.41) | — | |
| SCHEMBL2085247 | 0.72 | CA2 (0.41) | — | |
| SCHEMBL6830251 | 0.69 | CA2 (0.39) | — | |
| SCHEMBL6448264 | 0.69 | CA2 (0.39) | — |
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 139 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110054616-B | Preparation method of triazine IDH inhibitor | 南京圣和药业股份有限公司 | 2021-11-23 | — | — | CN | claimed |
| CN-104926646-A | Method for chemical synthesis of tanshinol and related analogues | XIE YANG | 2015-09-23 | — | — | CN | claimed |
| CN-104910111-A | Method for chemical synthesis of salvianolic acid B and its analogue | XIE YANG | 2015-09-16 | — | — | CN | claimed |
| CN-1902175-B | Synthesis of acyloxyalkyl carbamate prodrugs and intermediates thereof | XENOPORT INC | 2012-08-22 | — | — | CN | claimed |
| CN-102060768-B | Method for preparing 3, 3'or 3 ester-substituted chiral binaphthyl tertiary amine | UNIV SUN YAT SEN | 2012-05-02 | — | — | CN | claimed |
| CN-102060768-A | Method for preparing 3, 3'or 3 ester-substituted chiral binaphthyl tertiary amine | UNIV SUN YAT SEN | 2011-05-18 | — | — | CN | claimed |
| EP-0600317-B1 | Process for the preparation of halogenated benzoic acids | HOECHST AG (DE) | 1997-03-12 | — | — | EP | claimed |
| US-5481032-A | Process for the preparation of halogenated benzoic acids | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-01-02 | — | — | US | claimed |
| US-20240228878-A1 | COMPOUND, LIQUID CRYSTAL COMPOSITION, AS WELL AS LIQUID CRYSTAL DISPLAY ELEMENT, SENSOR, LIQUID CRYSTAL LENS, OPTICAL COMMUNICATION EQUIPMENT, AND ANTENNA EACH USING THE SAME | DIC CORPORATION (JP) | 2024-07-11 | — | — | US | disclosed |
| US-11999890-B2 | Surfactants for electronics | ADVANSIX RESINS AND CHEMICALS LLC (US) | 2024-06-04 | — | — | US | disclosed |
| US-20240174924-A1 | ETCHING COMPOSITIONS | FUJIFILM ELECTRONIC MATERIALS U.S.A., INC. | 2024-05-30 | — | — | US | disclosed |
| CN-111748590-B | Application of aminotransferase in preparation of Sacubitril intermediate | 弈柯莱(台州)药业有限公司 | 2024-05-28 | — | — | CN | disclosed |
| EP-4101009-B1 | SURFACTANTS FOR ELECTRONICS | ADVANSIX RESINS & CHEMICALS LLC (US) | 2024-04-17 | — | — | EP | disclosed |
| CN-114075307-B | Rare earth catalyst and preparation method and application thereof | 中国石油天然气股份有限公司 | 2024-03-26 | — | — | CN | disclosed |
| WO-1997045403-A1 | ARYL SUBSTITUTED CYCLIC AMINES AS SELECTIVE DOPAMINE D3 LIGANDS | PHARMACIA & UPJOHN COMPANY (US) | 1997-12-04 | — | — | WO | disclosed |
| EP-0766559-A4 | CANNABINOID RECEPTOR ANTAGONISTS | LILLY CO ELI (US) | 1997-08-06 | — | — | EP | disclosed |
| EP-0766559-A1 | CANNABINOID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1997-04-09 | — | — | EP | disclosed |
| US-5596106-A | ARYL-BENZO(B)THIOPHENE OR BENZO(B)FURAN COMPOUNDS | ELI LILLY AND COMPANY (US) | 1997-01-21 | — | — | US | disclosed |
| WO-1996002248-A1 | CANNABINOID RECEPTOR ANTAGONISTS | ELI LILLY AND COMPANY (US) | 1996-02-01 | — | — | WO | disclosed |
| US-5481032-A | Process for the preparation of halogenated benzoic acids | HOECHST AKTIENGESELLSCHAFT (DE) | 1996-01-02 | — | — | US | disclosed |