⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11304598 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL11306937 | 0.93 | — | — | |
| SCHEMBL29549354 | 0.72 | — | — | |
| SCHEMBL29619653 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL10976844 | 0.68 | — | — | |
| SCHEMBL3975001 | 0.61 | — | — | |
| SCHEMBL63975 | 0.61 | — | — | |
| Water SCHEMBL8782173 | 0.55 | — | — | |
| Ethylenediamine SCHEMBL3083 | 0.55 | — | — | |
| Hydrochloric Acid SCHEMBL4912905 | 0.55 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20040142976-A1 | Pyridylfuran and pyridylthiophene compounds | PFIZER INC. | 2004-07-22 | — | — | US | disclosed |
| US-4617409-A | Aminomethyltriorganotin compounds, preferably α-mono or disubstituted; and the method of preparation | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 1986-10-14 | — | — | US | disclosed |
| US-4362875-A | Process for preparing (1-acylaminomethyl)-1,2,3,4-tetrahydroisoquinolines | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1982-12-07 | — | — | US | disclosed |
| US-4051279-A | REMOVING MARINE ORGANISMS FROM SURFACES BY SCRAPING AFTER KILLING WITH AN ORGANO-TIN COMPOUND | THE PROCTER & GAMBLE COMPANY (US) | 1977-09-27 | — | — | US | disclosed |