⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1549296 | 0.86 | CA4 (0.31) | — | |
| SCHEMBL8389976 | 0.73 | — | — | |
| SCHEMBL7120907 | 0.72 | — | — | |
| SCHEMBL11207758 | 0.71 | — | — | |
| SCHEMBL2360759 | 0.71 | — | — | |
| SCHEMBL27689491 | 0.69 | TSHR (0.31) | — | |
| SCHEMBL5008757 | 0.69 | TSHR (0.31) | — | |
| SCHEMBL6703907 | 0.68 | ESR1 (0.34) | — | |
| SCHEMBL890423 | 0.68 | ESR1 (0.34) | — | |
| Biphenyl SCHEMBL19927531 | 0.68 | ALDH1A1 (0.50) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6602495-B2 | For conditioning and bodifying the hair | UNILEVER HOME & PERSONAL CARE USA DIVISION OF CONOPCO, INC. | 2003-08-05 | — | — | US | disclosed |
| US-20020090350-A1 | Hair care compositions and method for depositing swollen polymer particles onto hair | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2002-07-11 | — | — | US | disclosed |
| US-6355233-B1 | POLYSILOXANE CROSSLINKED WITH ALIPHATIC DIENE | UNILEVER HOME & PERSONAL CARE USA, DIVISION OF CONOPCO, INC. | 2002-03-12 | — | — | US | disclosed |