⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3729519 | 0.79 | — | — | |
| SCHEMBL30469268 | 0.75 | — | — | |
| SCHEMBL80565 | 0.75 | — | — | |
| SCHEMBL1312594 | 0.72 | — | — | |
| SCHEMBL40603 | 0.72 | — | — | |
| SCHEMBL6269096 | 0.72 | IDO1 (0.43) | — | |
| SCHEMBL435556 | 0.72 | — | — | |
| SCHEMBL1350393 | 0.72 | — | — | |
| SCHEMBL10800709 | 0.69 | ALDH1A1 (0.48) | — | |
| SCHEMBL3316990 | 0.69 | IDO1 (0.55) | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109111463-B | Method for producing aromatic compound | DIC株式会社 | 2022-07-01 | — | — | CN | disclosed |
| CN-102712619-B | 5-hydroxy pyrimidine-4-carboxamides derivatives | DAIICHI SANKYO Co.,Ltd. (JP) | 2015-11-25 | — | — | CN | disclosed |
| CN-102712619-A | 5-hydroxypyrimidine-4-carboxamide derivative | DAIICHI SANKYO CO LTD | 2012-10-03 | — | — | CN | disclosed |
| US-20050124597-A1 | Novel guanidinyl derivatives | BOYCE RUSTUM (US) | 2005-06-09 | — | — | US | disclosed |
| EP-1476156-A2 | PIPERIDINE OR PYRROLIDINE DERIVATIVES HAVING AN AMINOACYL SUBSTITUTED SIDE CHAIN AS MELANOCORTIN-4 RECEPTOR AGONISTS | CHIRON CORPORATION (US) | 2004-11-17 | — | — | EP | disclosed |
| US-20030207814-A1 | Novel guanidinyl derivatives | CHIRON CORPORATION | 2003-11-06 | — | — | US | disclosed |
| WO-2003066587-A2 | PIPERIDINE OR PYRROLIDINE DERIVATIVES HAVING AN AMINOACYL SUBSTITUTED SIDE CHAIN AS MELANCORTIN-4 RECEPTOR AGONISTS | CHIRON CORPORATION (US) | 2003-08-14 | — | — | WO | disclosed |
| CN-1268942-A | Sulfonamide compounds and medicinal use thereof | FUJISAWA PHARMACEUTICAL CO (JP) | 2000-10-04 | — | — | CN | disclosed |
| US-4579582-A | REDUCES THE GERMINATION OR EARLY GROWTH OF GRASSES | CHEVRON RESEARCH COMPANY (US) | 1986-04-01 | — | — | US | disclosed |
| US-4429119-A | PLANT GROWTH REGULATORS | CHEVRON RESEARCH COMPANY (US) | 1984-01-31 | — | — | US | disclosed |
| EP-0073566-A1 | Methods and compositions for combating soil pests | IMPERIAL CHEMICAL INDUSTRIES PLC (GB) | 1983-03-09 | — | — | EP | disclosed |