Known targets — ChEMBL curated mechanism
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7120509 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL9636700 | 0.80 | — | — | |
| SCHEMBL3967860 | 0.68 | CA2 (0.35) | — | |
| SCHEMBL27320729 | 0.68 | — | — | |
| SCHEMBL27868433 | 0.68 | — | — | |
| SCHEMBL1615586 | 0.68 | — | — | |
| SCHEMBL28154935 | 0.68 | TSHR (0.44) | — | |
| SCHEMBL27868438 | 0.67 | — | — | |
| SCHEMBL27418084 | 0.67 | CA1 (0.33) | — | |
| SCHEMBL4411396 | 0.66 | CA2 (0.36) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5149752-A | Comprising quarternized (meth)acrylate homo- and copolymers having urethane or urea groups; shampoo or hair conditioner | CLAIROL INCORPORATED (US) | 1992-09-22 | — | — | US | disclosed |
| US-5147635-A | For hair | CLAIROL INCORPORATED (US) | 1992-09-15 | — | — | US | disclosed |