⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4786313 | 0.57 | — | — | |
| SCHEMBL2041354 | 0.56 | — | — | |
| SCHEMBL7656436 | 0.54 | — | — | |
| SCHEMBL1665742 | 0.53 | — | — | |
| SCHEMBL8382035 | 0.49 | — | — | |
| SCHEMBL24514891 | 0.49 | — | — | |
| SCHEMBL25626251 | 0.49 | — | — | |
| Hydrochloric Acid SCHEMBL25382328 | 0.49 | — | — | |
| SCHEMBL1725392 | 0.47 | — | — | |
| SCHEMBL2503454 | 0.41 | CA2 (0.69) | — |
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-20240025942-A1 | NEUROACTIVE STEROIDS, COMPOSITIONS, AND USES THEREOF | SAGE THERAPEUTICS, INC. | 2024-01-25 | — | — | US | disclosed |
| US-20180224422-A1 | CONTROLLED TUNNEL GAP DEVICE FOR SEQUENCING POLYMERS | ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY | 2018-08-09 | — | — | US | disclosed |
| US-9810681-B2 | Controlled tunnel gap device for sequencing polymers | ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2017-11-07 | — | — | US | disclosed |
| US-20160097759-A1 | CONTROLLED TUNNEL GAP DEVICE FOR SEQUENCING POLYMERS | ARIZONA BOARD OF REGENTS ON BEHALF OF ARIZONA STATE UNIVERSITY | 2016-04-07 | — | — | US | disclosed |
| US-20150299221-A1 | MACROCYCLIC PURINES FOR THE TREATMENT OF VIRAL INFECTIONS | Janssen Sciences Ireland Unlimited Company (IE) | 2015-10-22 | — | — | US | disclosed |
| US-9140682-B2 | Controlled tunnel gap device for sequencing polymers | ARIZONA BOARD OF REGENTS, A BODY CORPORATE OF THE STATE OF ARIZONA ACTING FOR AND ON BEHALF OF ARIZONA STATE UNIVERSITY (US) | 2015-09-22 | — | — | US | disclosed |