⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18463797 | 0.74 | — | — | |
| SCHEMBL173628 | 0.74 | F2 (0.46) | — | |
| SCHEMBL7756006 | 0.71 | PKM (0.35) | — | |
| SCHEMBL28471636 | 0.69 | NOS1 (0.33) | — | |
| SCHEMBL221953 | 0.69 | AKR1C3 (0.38) | — | |
| SCHEMBL8682493 | 0.68 | TSHR (0.36) | — | |
| SCHEMBL10735365 | 0.68 | NOS1 (0.33) | — | |
| SCHEMBL20501067 | 0.65 | HTT (0.68) | — | |
| SCHEMBL4561815 | 0.63 | NOS1 (0.49) | — | |
| SCHEMBL29002968 | 0.61 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1390124-A | Medicine for preventing or treating myopia | YONGGUANG PHARMACY CO LTD (CN) | 2003-01-08 | — | — | CN | claimed |
| CN-112004845-B | Resin composition, laminate, semiconductor wafer with resin composition layer, substrate, and semiconductor device | 三菱瓦斯化学株式会社 | 2022-05-31 | — | — | CN | disclosed |
| CN-112004845-A | Resin composition, laminate, semiconductor wafer with resin composition layer, substrate for mounting semiconductor with resin composition layer, and semiconductor device | 三菱瓦斯化学株式会社 | 2020-11-27 | — | — | CN | disclosed |
| CN-111235597-B | Synthesis method of nitroazole energetic compound | 南京理工大学 | 2020-10-30 | — | — | CN | disclosed |
| CN-111235597-A | Synthesis method of nitroazole energetic compound | 南京理工大学 | 2020-06-05 | — | — | CN | disclosed |
| WO-2017019804-A2 | COMPOUNDS AND METHODS FOR KINASE MODULATION, AND INDICATIONS THEREFOR | PLEXXIKON INC. (US) | 2017-02-02 | — | — | WO | disclosed |
| CN-1390124-A | Medicine for preventing or treating myopia | YONGGUANG PHARMACY CO LTD (CN) | 2003-01-08 | — | — | CN | disclosed |
| EP-1090060-A1 | MODIFIED POLYCONDENSATES OF ASPARAGINIC ACID, METHOD FOR THE PRODUCTION THEREOF, AND THEIR USE IN FERTILIZERS | BASF AKTIENGESELLSCHAFT (DE) | 2001-04-11 | — | — | EP | disclosed |
| WO-1999058594-A1 | MODIFIED POLYCONDENSATES OF ASPARAGINIC ACID, METHOD FOR THE PRODUCTION THEREOF, AND THEIR USE IN FERTILIZERS | BASF AKTIENGESELLSCHAFT (DE) | 1999-11-18 | — | — | WO | disclosed |