⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9669807 | 0.97 | TSHR (0.46) | — | |
| SCHEMBL10580675 | 0.97 | TSHR (0.46) | — | |
| SCHEMBL9668492 | 0.97 | TSHR (0.46) | — | |
| SCHEMBL10581153 | 0.97 | TSHR (0.46) | — | |
| SCHEMBL8873869 | 0.92 | — | — | |
| SCHEMBL10579490 | 0.82 | TSHR (0.52) | — | |
| SCHEMBL11852314 | 0.82 | TSHR (0.46) | — | |
| SCHEMBL10579601 | 0.82 | TSHR (0.52) | — | |
| SCHEMBL11852362 | 0.80 | TSHR (0.43) | — | |
| SCHEMBL11858536 | 0.80 | TSHR (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2205204-A1 | THERAPY OPTION FOR RECOLORATION OF HAIR VIA BISPHOSPHONATES BY PHYSIOLOGICAL REPIGMENTATION WITH AGE-RELATED AND/OR PREMATURE \"GRAYED\" PATIENTS | Merz Pharma GmbH & Co. KGaA (DE) | 2010-07-14 | — | — | EP | disclosed |
| WO-2009059966-A1 | THERAPY OPTION FOR RECOLORATION OF HAIR VIA BISPHOSPHONATES BY PHYSIOLOGICAL REPIGMENTATION WITH AGE-RELATED AND/OR PREMATURE 'GRAYED' PATIENTS | MERZ PHARMA GMBH & CO. KGAA (DE) | 2009-05-14 | — | — | WO | disclosed |
| US-3996193-A | POLYALKYLENEPOLYAMINES, DIOLEFIN RUBBER | THE DOW CHEMICAL COMPANY (US) | 1976-12-07 | — | — | US | disclosed |