⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4752842 | 1.00 | — | — | |
| SCHEMBL4750588 | 0.96 | — | — | |
| SCHEMBL1961601 | 0.96 | — | — | |
| SCHEMBL4750590 | 0.96 | — | — | |
| Ammonia Solution, Strong SCHEMBL4752875 | 0.93 | — | — | |
| Ammonia Solution, Strong SCHEMBL4750410 | 0.89 | — | — | |
| SCHEMBL4750455 | 0.89 | — | — | |
| SCHEMBL4753943 | 0.89 | — | — | |
| SCHEMBL1961554 | 0.89 | — | — | |
| SCHEMBL895689 | 0.81 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2006057727-A1 | COMPOSITIONS AND METHODS FOR WHITENING, MINERALIZING AND/OR FLUORIDATING CALCIFIED TISSUES | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2006-06-01 | — | — | WO | claimed |
| WO-2006057857-A2 | COMPOSITIONS AND METHODS FOR WHITENING, MINERALIZING AND/OR FLUORIDATING CALCIFIED TISSUES | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2006-06-01 | — | — | WO | claimed |
| US-20060110340-A1 | Compositions and methods for whitening, mineralizing and/or fluoridating calcified tissues | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2006-05-25 | — | — | US | claimed |
| US-9320692-B2 | Tooth fluoridating and remineralizing compositions and methods, based on nanoaggregate formation | ADA FOUNDATION (US) | 2016-04-26 | — | — | US | disclosed |
| WO-2012119155-A1 | ANTIMICROBIAL COMPOSITIONS FOR TOOTH FLUORIDATION AND REMINERALIZATION | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2012-09-07 | — | — | WO | disclosed |
| WO-2008147997-A1 | TOOTH FLUORIDATING AND REMINERALIZING COMPOSITIONS AND METHODS, BASED ON NANOAGGREGATE FORMATION | ADA FOUNDATION (US) | 2008-12-04 | — | — | WO | disclosed |
| US-20080292565-A1 | TOOTH FLUORIDATING AND REMINERALIZING COMPOSITIONS AND METHODS, BASED ON NANOAGGREGATE FORMATION | ADA FOUNDATION (US) | 2008-11-27 | — | — | US | disclosed |
| WO-2006057857-A2 | COMPOSITIONS AND METHODS FOR WHITENING, MINERALIZING AND/OR FLUORIDATING CALCIFIED TISSUES | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2006-06-01 | — | — | WO | disclosed |
| WO-2006057727-A1 | COMPOSITIONS AND METHODS FOR WHITENING, MINERALIZING AND/OR FLUORIDATING CALCIFIED TISSUES | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2006-06-01 | — | — | WO | disclosed |
| US-20060110340-A1 | Compositions and methods for whitening, mineralizing and/or fluoridating calcified tissues | AMERICAN DENTAL ASSOCIATION FOUNDATION (US) | 2006-05-25 | — | — | US | disclosed |