⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1228631 | 0.81 | — | — | |
| SCHEMBL11213746 | 0.76 | — | — | |
| SCHEMBL8090825 | 0.76 | CYP4F2 (0.36) | — | |
| SCHEMBL11402355 | 0.74 | NAAA (0.31) | — | |
| SCHEMBL11401759 | 0.74 | — | — | |
| SCHEMBL109472 | 0.72 | — | — | |
| SCHEMBL133254 | 0.71 | — | — | |
| SCHEMBL14892543 | 0.71 | CYP4F2 (0.35) | — | |
| SCHEMBL890939 | 0.70 | — | — | |
| SCHEMBL1483835 | 0.70 | CYP4F2 (0.37) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-103080269-B | Photochromic composition | TOKUYAMA CORP. (JP) | 2015-12-16 | — | — | CN | disclosed |
| US-4931287-A | CROSSLINKED HYDROPHOBIOC AND HYDROPHILIC POLYMERS IN MATRIX AND DISPERSED ZONES; DRUG DELIVERY | UNIVERSITY OF UTAH (US) | 1990-06-05 | — | — | US | disclosed |
| EP-0347145-A2 | Heterogeneous interpenetrating polymer networks for the controlled release of drugs | UNIVERSITY OF UTAH RESEARCH FOUNDATION (US) | 1989-12-20 | — | — | EP | disclosed |