⚠ 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 | |
|---|---|---|---|---|
| Propene SCHEMBL28681564 | 0.75 | — | — | |
| Propene SCHEMBL23933828 | 0.75 | — | — | |
| SCHEMBL1560310 | 0.73 | CA1 (0.86) | — | |
| SCHEMBL2135832 | 0.72 | — | — | |
| Hydrogen Sulfide SCHEMBL1276869 | 0.69 | CA1 (0.75) | — | |
| SCHEMBL15864274 | 0.69 | CA1 (0.75) | — | |
| SCHEMBL15864291 | 0.69 | CA1 (0.75) | — | |
| Ethylene SCHEMBL15798932 | 0.69 | — | — | |
| Ammonia Solution, Strong SCHEMBL8568479 | 0.69 | — | — | |
| SCHEMBL11412913 | 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 |
|---|---|---|---|---|---|---|---|
| WO-2014194376-A1 | BENZYLAMINE, BENZYLAMINE DERIVATIVES AND BENZYLAMINE MIXTURES FOR CO2 REMOVAL FROM GAS STREAMS | COMMONWEALTH SCIENTIFIC AND INDUSTRIAL RESEARCH ORGANISATION (AU) | 2014-12-11 | — | — | WO | claimed |
| WO-2021041162-A1 | IMPROVED SOLUTION-PROCESSABLE TRIAZOLE-BASED POLYMERS AND METHODS OF MAKING THE SAME | GEORGIA TECH RESEARCH CORPORATION (US) | 2021-03-04 | — | — | WO | disclosed |
| CN-101426497-A | Small molecule apoptosis promoters | JOYANT PHARMACEUTICALS INC (US) | 2009-05-06 | — | — | CN | disclosed |
| CN-101348503-A | O,O'-amino malonate and N, O-amino malonate platinum complex compound | ACCESS PHARMACEUTICAL CO LTD (US) | 2009-01-21 | — | — | CN | disclosed |
| CN-1209061-A | Hematoregulator compounds | SMITHKLINE BEECHAM CORP (US) | 1999-02-24 | — | — | CN | disclosed |
| US-4948706-A | COATING ONE SIDE WITH A PIGMENT OR DYE CONTAINING RESIN, APPLYING LIGHT TO BACK SIDE OF THE SUBSTRATE TO CURE | HOYA CORPORATION (JP) | 1990-08-14 | — | — | US | disclosed |