⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL94416 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL23440350 | 0.83 | — | — | |
| SCHEMBL794231 | 0.67 | — | — | |
| SCHEMBL794462 | 0.65 | — | — | |
| SCHEMBL6554587 | 0.62 | TRPV1 (0.32) | — | |
| SCHEMBL8116563 | 0.62 | TRPV1 (0.32) | — | |
| SCHEMBL52132 | 0.62 | — | — | |
| SCHEMBL9118614 | 0.62 | — | — | |
| SCHEMBL3400691 | 0.62 | — | — | |
| SCHEMBL9364312 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20210296602-A1 | DONOR-ACCEPTOR INTERFACES FOR EXCITONIC SEMICONDUCTORS | UNITED STATES DEPARTMENT OF ENERGY | 2021-09-23 | — | — | US | claimed |
| US-20210296602-A1 | DONOR-ACCEPTOR INTERFACES FOR EXCITONIC SEMICONDUCTORS | UNITED STATES DEPARTMENT OF ENERGY | 2021-09-23 | — | — | US | disclosed |
| WO-2020040844-A1 | DONOR-ACCEPTOR INTERFACES FOR EXCITONIC SEMICONDUCTORS | THE TRUSTEES OF PRINCETON UNIVERSITY (US) | 2020-02-27 | — | — | WO | disclosed |