⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL220757 | 0.74 | — | — | |
| SCHEMBL9098689 | 0.74 | — | — | |
| SCHEMBL1411653 | 0.74 | — | — | |
| SCHEMBL5178129 | 0.74 | — | — | |
| SCHEMBL5851070 | 0.74 | — | — | |
| SCHEMBL11580343 | 0.74 | — | — | |
| SCHEMBL10585144 | 0.74 | — | — | |
| SCHEMBL5480767 | 0.73 | — | — | |
| SCHEMBL8997947 | 0.72 | — | — | |
| SCHEMBL16966402 | 0.70 | ALDH1A1 (0.33) | — |
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 17 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0643695-B1 | FUNGICIDAL INDOLE DERIVATIVES | SHELL INT RESEARCH (NL) | 1996-08-14 | — | — | EP | claimed |
| EP-0643695-A1 | FUNGICIDAL INDOLE DERIVATIVES. | SHELL INT RESEARCH (NL) | 1995-03-22 | — | — | EP | claimed |
| US-5399559-A | Control of phytopathogens | SHELL RESEARCH LIMITED (GB) | 1995-03-21 | — | — | US | claimed |
| CN-1082318-A | Fungicidal indole derivatives | SHELL INT RESEARCH (NL) | 1994-02-23 | — | — | CN | claimed |
| WO-1993025524-A1 | FUNGICIDAL INDOLE DERIVATIVES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1993-12-23 | — | — | WO | claimed |
| US-20040180947-A1 | hypoglycemic activity or phoshodiesterase-V inhibitory activity; prophylaxis and treatment of impaired glucose tolerance disorder, diabetes (e.g., type II diabetes), diabetic complications | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-09-16 | — | — | US | disclosed |
| EP-0643695-B1 | FUNGICIDAL INDOLE DERIVATIVES | SHELL INT RESEARCH (NL) | 1996-08-14 | — | — | EP | disclosed |
| EP-0643695-A1 | FUNGICIDAL INDOLE DERIVATIVES. | SHELL INT RESEARCH (NL) | 1995-03-22 | — | — | EP | disclosed |
| US-5399559-A | Control of phytopathogens | SHELL RESEARCH LIMITED (GB) | 1995-03-21 | — | — | US | disclosed |
| CN-1082318-A | Fungicidal indole derivatives | SHELL INT RESEARCH (NL) | 1994-02-23 | — | — | CN | disclosed |
| WO-1993025524-A1 | FUNGICIDAL INDOLE DERIVATIVES | SHELL INTERNATIONALE RESEARCH MAATSCHAPPIJ B.V. (NL) | 1993-12-23 | — | — | WO | disclosed |
| US-4122062-A | FILLERS | KENRICH PETROCHEMICALS, INC. (US) | 1978-10-24 | — | — | US | disclosed |
| US-4098758-A | ORGANIC ACIDS, FOR USE IN POLYMER SYSTEMS | KENRICH PETROCHEMICALS, INC. (US) | 1978-07-04 | — | — | US | disclosed |
| US-4096110-A | Filled polyesters containing organic titanate esters | KENRICH PETROCHEMICALS, INC. (US) | 1978-06-20 | — | — | US | disclosed |
| US-4094853-A | Alkoxy titanate salts useful as coupling agents | KENRICH PETROCHEMICALS, INC. (US) | 1978-06-13 | — | — | US | disclosed |
| US-4087402-A | USED FOR TREATMENT OF INORGANIC FILLERS | KENRICH PETROCHEMICALS, INC. (US) | 1978-05-02 | — | — | US | disclosed |
| US-4069192-A | ORGANIC | KENRICH PETROCHEMICALS, INC. (US) | 1978-01-17 | — | — | US | disclosed |