⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4993796 | 0.87 | FBP1 (0.42) | — | |
| SCHEMBL6286919 | 0.86 | EPHX1 (0.52) | — | |
| SCHEMBL19003867 | 0.85 | EPHX1 (0.58) | — | |
| SCHEMBL6287750 | 0.84 | EPHX1 (0.56) | — | |
| SCHEMBL23173031 | 0.84 | EPHX1 (0.52) | — | |
| SCHEMBL6287140 | 0.82 | EPHX1 (0.59) | — | |
| SCHEMBL6290290 | 0.81 | EPHX1 (0.68) | — | |
| SCHEMBL28293734 | 0.81 | MMP1 (0.48) | — | |
| SCHEMBL320068 | 0.81 | — | — | |
| SCHEMBL14198101 | 0.79 | EPHX1 (0.68) | — |
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-109666120-A | A kind of energy-absorbing method based on hydridization dynamic aggregation object | 翁秋梅 | 2019-04-23 | — | — | CN | disclosed |
| CN-109666168-A | A kind of self-repairability solid-state hydridization dynamic aggregation object and its application | 翁秋梅 | 2019-04-23 | — | — | CN | disclosed |
| US-6916854-B2 | Heat and/or light curable films or coatings comprising polyurethanes or polyureaurethane copolymers having storage stability, used as automobile paints | BASF AKTIENGESELLSCHAFT (DE) | 2005-07-12 | — | — | US | disclosed |
| US-20040097642-A1 | Unsaturated compounds containing carbamate terminal groups or urea terminal groups | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-20 | — | — | US | disclosed |
| US-3985564-A | Photographic element and process for developing | EASTMAN KODAK COMPANY (US) | 1976-10-12 | — | — | US | disclosed |