⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9327403 | 0.79 | FDPS (0.31) | — | |
| SCHEMBL6753894 | 0.67 | — | — | |
| SCHEMBL2583565 | 0.64 | — | — | |
| SCHEMBL6129132 | 0.63 | — | — | |
| SCHEMBL8543447 | 0.60 | — | — | |
| SCHEMBL35120 | 0.60 | — | — | |
| SCHEMBL7632472 | 0.59 | — | — | |
| SCHEMBL9002598 | 0.57 | — | — | |
| SCHEMBL12486840 | 0.57 | — | — | |
| SCHEMBL4407516 | 0.57 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5085976-A | Post-exposed to ultraviolet radiation | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-02-04 | — | — | US | disclosed |
| US-4847182-A | Method for developing a photopolymer printing plate using a developer comprising terpene hydrocarbons | W. R. GRACE & CO. (US) | 1989-07-11 | — | — | US | disclosed |