⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15677667 | 0.80 | — | — | |
| SCHEMBL20077485 | 0.80 | — | — | |
| SCHEMBL16088784 | 0.80 | — | — | |
| SCHEMBL1959840 | 0.76 | — | — | |
| SCHEMBL17946153 | 0.74 | CHRM2 (0.36) | — | |
| SCHEMBL9066543 | 0.74 | CHRM2 (0.36) | — | |
| SCHEMBL8366697 | 0.72 | PTGER4 (0.46) | — | |
| SCHEMBL10411308 | 0.72 | MAPK1 (0.35) | — | |
| SCHEMBL19973705 | 0.70 | — | — | |
| SCHEMBL6109780 | 0.70 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114907514-A | Multifunctional fiber and preparation method and application thereof | 北京洁尔爽高科技有限公司 | 2022-08-16 | — | — | CN | disclosed |
| CN-110049869-A | Extrusion matt foil with improved mechanical performance and high-weatherability | 赢创罗姆有限公司 | 2019-07-23 | — | — | CN | disclosed |
| US-5496958-A | Preparation of 5-vinylpyrrolidones | BASF AKTIENGESELLSCHAFT (DE) | 1996-03-05 | — | — | US | disclosed |
| US-5006511-A | Treating hypertension, congestive heart failure | MERCK & CO., INC. (US) | 1991-04-09 | — | — | US | disclosed |
| EP-0312283-A2 | Di-or tripeptide renin inhibitors containing lactam conformational restrictions in ACHPA | MERCK & CO. INC. (US) | 1989-04-19 | — | — | EP | disclosed |