⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3149309 | 0.91 | TSHR (0.31) | — | |
| SCHEMBL37160 | 0.77 | ALDH1A1 (0.33) | — | |
| SCHEMBL11212031 | 0.75 | ALDH1A1 (0.32) | — | |
| SCHEMBL9183752 | 0.74 | ALDH1A1 (0.34) | — | |
| SCHEMBL20602960 | 0.74 | TSHR (0.31) | — | |
| SCHEMBL7937610 | 0.74 | — | — | |
| SCHEMBL22042690 | 0.71 | — | — | |
| SCHEMBL11060213 | 0.70 | TDP1 (0.31) | — | |
| SCHEMBL8849738 | 0.69 | TSHR (0.33) | — | |
| SCHEMBL954310 | 0.68 | THRB (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1383470-B1 | HAIR TREATMENT COMPOSITIONS | UNILEVER PLC (GB) | 2009-06-17 | — | — | EP | disclosed |
| EP-1383860-B1 | FABRIC CARE COMPOSITIONS | UNILEVER PLC (GB) | 2005-10-12 | — | — | EP | disclosed |
| US-6696051-B2 | CONTAINING CORE PARTICLES HAVING A D3,2 AVERAGE PARTICLE SIZE OF 10-700 NM, AND COATED WITH COVALENTLY BONDED SILICONE POLYMER | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2004-02-24 | — | — | US | disclosed |
| US-6696050-B2 | COATED PARTICLES COMPRISING (A) A SOLID CORE HAVING A D3, 2 AVERAGE PARTICLE SIZE IN THE RANGE FROM 10 TO 700 NM, AND (B) A COATING POLYMER COVALENTLY BONDED TO THE SOLID CORE; E.G., SOLID SILICA CORES AND POLYSTYRENE COATING POLYMER | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2004-02-24 | — | — | US | disclosed |
| US-20030095943-A1 | Hair treatment compositions | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2003-05-22 | — | — | US | disclosed |
| US-20030012757-A1 | Hair treatment compositions | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2003-01-16 | — | — | US | disclosed |