⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11249346 | 0.89 | — | — | |
| SCHEMBL11249353 | 0.89 | — | — | |
| SCHEMBL2080226 | 0.84 | — | — | |
| SCHEMBL11688225 | 0.82 | — | — | |
| SCHEMBL22806875 | 0.82 | — | — | |
| SCHEMBL818561 | 0.76 | — | — | |
| SCHEMBL18632180 | 0.74 | — | — | |
| SCHEMBL21827283 | 0.73 | — | — | |
| SCHEMBL21828227 | 0.73 | — | — | |
| SCHEMBL2540638 | 0.73 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4215068-A | Preparation of 1,3-dicyanocyclopentane | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1980-07-29 | — | — | US | claimed |
| US-7838609-B2 | Polyvinyl alcohol type resin, monolayer film and laminate | THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) | 2010-11-23 | — | — | US | disclosed |
| US-20080200633-A1 | Polyvinyl alcohol type resin, monolayer film and laminate | THE NIPPON SYNTHETIC CHEMICAL INDUSTRY CO., LTD. (JP) | 2008-08-21 | — | — | US | disclosed |
| EP-0705263-A1 | NOVEL CARBOCYCLIC NUCLEOSIDE AGENTS USEFUL AS SELECTIVE INHIBITORS OF PROINFLAMMATORY CYTOKINES | MERRELL PHARMA INC (US) | 1996-04-10 | — | — | EP | disclosed |
| WO-1995000514-A1 | NOVEL CARBOCYCLIC NUCLEOSIDE AGENTS USEFUL AS SELECTIVE INHIBITORS OF PROINFLAMMATORY CYTOKINES | MERRELL PHARMACEUTICALS INC. (US) | 1995-01-05 | — | — | WO | disclosed |
| US-4215068-A | Preparation of 1,3-dicyanocyclopentane | GULF RESEARCH & DEVELOPMENT COMPANY (US) | 1980-07-29 | — | — | US | disclosed |