⚠ 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 | |
|---|---|---|---|---|
| Sulfuric Acid SCHEMBL8517991 | 0.89 | — | — | |
| SCHEMBL1122230 | 0.79 | — | — | |
| SCHEMBL29236046 | 0.77 | — | — | |
| SCHEMBL28300405 | 0.75 | — | — | |
| SCHEMBL30721508 | 0.73 | — | — | |
| SCHEMBL28400917 | 0.72 | TDP1 (0.34) | — | |
| SCHEMBL9586241 | 0.71 | — | — | |
| SCHEMBL28703048 | 0.70 | — | — | |
| SCHEMBL30163541 | 0.69 | — | — | |
| SCHEMBL27896020 | 0.69 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4046503-A | DEVELOPER-COUPLER HAIR DYES BASED ON ALKOXY-TRIAMINO-PYRIMIDINES | HENKEL & CIE GMBH (DT) | 1977-09-06 | — | — | US | claimed |
| US-4043750-A | OXIDATION | HENKEL & CIE GMBH (DT) | 1977-08-23 | — | — | US | claimed |
| EP-0658099-B1 | ANTI-FREE-RADICAL TOPICAL COMPOSITION BASED ON A SUPEROXIDE DISMUTASE AND A PHOSPHONIC DERIVATIVE | OREAL (FR) | 1997-08-13 | — | — | EP | disclosed |
| EP-0658099-A1 | ANTI-FREE-RADICAL TOPICAL COMPOSITION BASED ON A SUPEROXIDE DISMUTASE AND A PHOSPHONIC DERIVATIVE. | OREAL (FR) | 1995-06-21 | — | — | EP | disclosed |
| US-5352438-A | Used to protect skin from aging and radiation exposure | L'OREAL (FR) | 1994-10-04 | — | — | US | disclosed |
| WO-1992019224-A2 | ANTI-FREE-RADICAL TOPICAL COMPOSITION BASED ON A SUPEROXIDE DISMUTASE AND A PHOSPHONIC DERIVATIVE | L'OREAL (FR) | 1992-11-12 | — | — | WO | disclosed |
| US-4566876-A | COLORFAST SHADES OF BLUE AND BROWN | CLAIROL INCORPORATED (US) | 1986-01-28 | — | — | US | disclosed |
| US-4417896-A | NITRO-,AMINO-,PHENOXYALKANOLS | SOCIETE ANONYME DITE: L'OREAL (FR) | 1983-11-29 | — | — | US | disclosed |
| US-4337061-A | NITRO DYES IN AQUEOUS SOLUTION | SOCIETE ANONYME DITE: L'OREAL (FR) | 1982-06-29 | — | — | US | disclosed |