⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1395476 | 0.80 | — | — | |
| SCHEMBL11452796 | 0.80 | — | — | |
| SCHEMBL43027 | 0.78 | — | — | |
| SCHEMBL8356305 | 0.73 | — | — | |
| SCHEMBL28612838 | 0.73 | — | — | |
| SCHEMBL5372488 | 0.73 | — | — | |
| SCHEMBL4364599 | 0.73 | — | — | |
| SCHEMBL82506 | 0.72 | — | — | |
| SCHEMBL9841402 | 0.72 | — | — | |
| SCHEMBL7109936 | 0.72 | — | — |
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 13 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111377856-B | R-type pyridyloxy carboxylic acid and salt and ester derivatives thereof, preparation method, herbicidal composition and application | 青岛清原化合物有限公司 | 2021-08-27 | — | — | CN | disclosed |
| CN-105261788-A | Electrolyte and lithium ion battery including same | NINGDE AMPEREX TECHNOLOGY LTD | 2016-01-20 | — | — | CN | disclosed |
| US-20100168175-A1 | ATPENINS | BAYER CROPSCIENCE AG (DE) | 2010-07-01 | — | — | US | disclosed |
| WO-2010069495-A1 | ATPENINS | BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) | 2010-06-24 | — | — | WO | disclosed |
| EP-0719839-B1 | Phthalocyanine compounds and optical recording media comprising them | MITSUI CHEMICALS INC (JP) | 2001-07-25 | — | — | EP | disclosed |
| US-5693396-A | NEAR INFRARED LIGHT ABSORBERS | MITSUI TOATSU CHEMICALS, INC. (JP) | 1997-12-02 | — | — | US | disclosed |
| US-5644063-A | VIRICIDES AND INDUCTION OF INTERFERON BIOSYNTHESIS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1997-07-01 | — | — | US | disclosed |
| EP-0719839-A2 | Phthalocyanine compounds and optical recording media comprising them | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1996-07-03 | — | — | EP | disclosed |
| US-5494916-A | VIRICIDES, AGENTS THAT INDUCE INTERFERON BIOSYNTHESIS | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1996-02-27 | — | — | US | disclosed |
| US-5446153-A | For inducing interferon biosynthesis; immunomodulators | MINNESOTA MINING AND MANUFACTURING COMPANY (US) | 1995-08-29 | — | — | US | disclosed |
| US-5330952-A | Catalyst compositions | SHELL OIL COMPANY (US) | 1994-07-19 | — | — | US | disclosed |
| US-5229475-A | CO/OLEFIN POLYMERIZATION WITH CARBOXYLIC ACID OR PHENOL | SHELL OIL COMPANY (US) | 1993-07-20 | — | — | US | disclosed |
| US-5122591-A | POLYMERIZATION OF CO/OLEFIN WITH INCREASED CATALYST COMPOSITION CONCENTRATION DURING POLYMERIZATION START UP | SHELL OIL COMPANY (US) | 1992-06-16 | — | — | US | disclosed |