⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2187089 | 0.86 | APP (0.39) | — | |
| SCHEMBL18050324 | 0.76 | ALDH1A1 (0.58) | — | |
| SCHEMBL219074 | 0.76 | ALDH1A1 (0.58) | — | |
| SCHEMBL9445826 | 0.76 | GRM5 (0.64) | — | |
| SCHEMBL4457730 | 0.76 | GRM5 (0.64) | — | |
| SCHEMBL18050322 | 0.76 | ALDH1A1 (0.58) | — | |
| SCHEMBL2577820 | 0.75 | CYP1A1 (0.54) | — | |
| SCHEMBL9715647 | 0.73 | GRM5 (0.61) | — | |
| P-Xylene SCHEMBL460348 | 0.73 | ACHE (1.00) | — | |
| P-Xylene SCHEMBL11770184 | 0.73 | ACHE (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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9902847-B2 | 4-methyl-1-pentene (co)polymer composition, and film and hollow molded product composed of the composition | MITSUI CHEMICALS, INC. (JP) | 2018-02-27 | — | — | US | disclosed |
| EP-2799488-B1 | 4-METHYL-1-PENTENE (CO)POLYMER COMPOSITION, AND FILM AND HOLLOW MOLDED BODY, EACH OF WHICH IS FORMED FROM 4-METHYL-1-PENTENE (CO)POLYMER COMPOSITION | MITSUI CHEMICALS INC (JP) | 2016-07-20 | — | — | EP | disclosed |
| EP-2976333-A1 | QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS | Genoscience Pharma SAS (FR) | 2016-01-27 | — | — | EP | disclosed |
| US-20140342111-A1 | 4-METHYL-1-PENTENE (CO)POLYMER COMPOSITION, AND FILM AND HOLLOW MOLDED PRODUCT COMPOSED OF THE COMPOSITION | MITSUI CHEMICALS, INC. (JP) | 2014-11-20 | — | — | US | disclosed |
| EP-2799488-A1 | 4-METHYL-1-PENTENE (CO)POLYMER COMPOSITION, AND FILM AND HOLLOW MOLDED BODY, EACH OF WHICH IS FORMED FROM 4-METHYL-1-PENTENE (CO)POLYMER COMPOSITION | Mitsui Chemicals, Inc. (JP) | 2014-11-05 | — | — | EP | disclosed |
| WO-2014147611-A1 | QUINOLINES DERIVATIVES AS NOVEL ANTICANCER AGENTS | GENOSCIENCE PHARMA (FR) | 2014-09-25 | — | — | WO | disclosed |
| US-20100190941-A1 | TRANSITION METAL COMPOUND, CATALYST FOR OLEFIN POLYMERIZATION, AND PROCESS FOR PRODUCING OLEFIN POLYMER | MITSUI CHEMICALS, INC. | 2010-07-29 | — | — | US | disclosed |