⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31560220 | 0.97 | CES2 (0.43) | — | |
| SCHEMBL31560221 | 0.97 | CES2 (0.43) | — | |
| SCHEMBL30972300 | 0.97 | CES2 (0.43) | — | |
| SCHEMBL31560219 | 0.97 | CES2 (0.43) | — | |
| SCHEMBL8119186 | 0.84 | CES2 (0.60) | — | |
| SCHEMBL25174 | 0.84 | — | — | |
| SCHEMBL1640046 | 0.84 | — | — | |
| SCHEMBL2729845 | 0.83 | — | — | |
| SCHEMBL11204502 | 0.83 | — | — | |
| Benzene SCHEMBL11654948 | 0.81 | HDAC3 (0.56) | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11718758-B2 | Aqueous dispersion of colored particles | MITSUBISHI PENCIL COMPANY, LIMITED (JP) | 2023-08-08 | — | — | US | disclosed |
| EP-3725854-B1 | COLORED PARTICLE AQUEOUS DISPERSION | MITSUBISHI PENCIL CO (JP) | 2023-07-05 | — | — | EP | disclosed |
| US-20230183258-A1 | NLRP3 MODULATORS | ZOMAGEN BIOSCIENCES LTD | 2023-06-15 | — | — | US | disclosed |
| US-9981908-B2 | Amino acid derivatives | MEDIMMUNE LIMITED (GB) | 2018-05-29 | — | — | US | disclosed |
| US-20160176811-A1 | Amino Acid Derivatives | ALLOZYNE, INC. | 2016-06-23 | — | — | US | disclosed |
| CN-101184487-B | Bicyclic pyrazole compounds as antibacterial agents | JANSSEN PHARMACEUTICA NV | 2010-11-03 | — | — | CN | disclosed |
| EP-1953147-A1 | HETEROCYCLIC COMPOUND AND MEDICINAL APPLICATION THEREOF | Japan Tobacco, Inc. (JP) | 2008-08-06 | — | — | EP | disclosed |
| CN-101184487-A | Bicyclic pyrazole compounds as antibacterial agents | JANSSEN PHARMACEUTICA NV (BE) | 2008-05-21 | — | — | CN | disclosed |
| US-6380231-B1 | FOR CONTROLLING ANIMAL AND FUNGAL PESTS | BASF AKTIENGESELLSCAHFT (DE) | 2002-04-30 | — | — | US | disclosed |
| US-5935986-A | PESTICIDES, FUNGICIDES; ETHERIFICATION | BASF AKTIENGESELLSCHAFT (DE) | 1999-08-10 | — | — | US | disclosed |