⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11726569 | 0.83 | — | — | |
| SCHEMBL5340689 | 0.79 | GPR84 (0.58) | — | |
| SCHEMBL28210417 | 0.79 | GPR84 (0.58) | — | |
| SCHEMBL6067598 | 0.79 | GPR84 (0.58) | — | |
| SCHEMBL10375181 | 0.75 | — | — | |
| SCHEMBL3877981 | 0.74 | CES2 (0.39) | — | |
| Hydrochloric Acid SCHEMBL27414386 | 0.72 | — | — | |
| SCHEMBL166461 | 0.71 | — | — | |
| SCHEMBL564112 | 0.69 | — | — | |
| SCHEMBL17449772 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210289794-A1 | COMPOSITIONS AND RELATED METHODS FOR AGRICULTURE | FLAGSHIP PIONEERING INNOVATIONS V, INC. | 2021-09-23 | — | — | US | disclosed |
| CN-102099322-A | Thermal salt-splitting of ammonium carboxylates | EVONIK ROEHM GMBH | 2011-06-15 | — | — | CN | disclosed |
| CN-1101380-C | 4-mercaptopyrrolidine derivatives as farnesyl transferase inhibitors | ZENECA LTD (GB) | 2003-02-12 | — | — | CN | disclosed |
| CN-1377647-A | 4-mercaptopyrrolidinyl derivative as fernesyl transferase inhibitor | ZENECA LTD (GB) | 2002-11-06 | — | — | CN | disclosed |
| US-6218518-B1 | FOR FORMING GROUP II THIN FILMS ON SUBSTRATES FOR MICROELECTRONIC DEVICE APPLICATIONS SUCH AS INTEGRATED CIRCUITS, FERROELECTRIC MEMORIES, SWITCHES, RADIATION DETECTORS, THIN-FILM CAPACITORS, HOLOGRAPHIC STORAGE | ADVANCED TECHNOLOGY MATERIALS, INC. | 2001-04-17 | — | — | US | disclosed |
| CN-1197453-A | 4-mercaptopyrrolidine derivatives as farnesyl transferase inhibitors | ZENECA LTD (GB) | 1998-10-28 | — | — | CN | disclosed |
| US-5677432-A | FORMING IMMUNOCONJUGATES FOR DETECTION OF ORGANOPHOSPHATE PESTICIDES | THE HORTICULTURE AND FOOD RESEARCH INSTITUTE OF NEW ZEALAND LIMITED (NZ) | 1997-10-14 | — | — | US | disclosed |