⚠ 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 | |
|---|---|---|---|---|
| Urea SCHEMBL27639021 | 0.86 | ALDH1A1 (0.55) | — | |
| Urea SCHEMBL8517667 | 0.82 | — | — | |
| Urea SCHEMBL687586 | 0.78 | — | — | |
| Urea SCHEMBL11859745 | 0.78 | LMNA (0.75) | — | |
| Urea SCHEMBL20456 | 0.78 | — | — | |
| Urea SCHEMBL3426239 | 0.78 | LMNA (0.75) | — | |
| Urea SCHEMBL6845937 | 0.78 | LMNA (0.75) | — | |
| Urea SCHEMBL36685 | 0.78 | — | — | |
| Urea SCHEMBL4454525 | 0.78 | LMNA (0.75) | — | |
| Urea SCHEMBL27746018 | 0.78 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110087641-A | Transdermal therapeutic system comprising asenapine and polysiloxane or polyisobutylene | 罗曼治疗系统股份公司 | 2019-08-02 | — | — | CN | disclosed |
| CN-108025248-A | Absorbent and process for selective removal of hydrogen sulfide | 巴斯夫欧洲公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-104812762-B | Substituted cyclic pyrimidin and triazine and their purposes | 拜耳药业股份公司 | 2018-01-16 | — | — | CN | disclosed |
| US-4320208-A | Process for the production of polyurethane plastics in which polyisocyanates are reacted with reactive organic fillers comprising biomasses | BAYER AKTIENGESELLSCHAFT (DE) | 1982-03-16 | — | — | US | disclosed |