⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20412281 | 0.97 | IMPDH2 (0.30) | — | |
| SCHEMBL94818 | 0.81 | GFER (0.34) | — | |
| SCHEMBL11372812 | 0.74 | GSK3B (0.44) | — | |
| SCHEMBL2749936 | 0.73 | CYP3A4 (0.32) | — | |
| SCHEMBL21309916 | 0.72 | CYP3A4 (0.38) | — | |
| SCHEMBL14507766 | 0.72 | ALDH1A1 (0.39) | — | |
| SCHEMBL28743710 | 0.71 | ALDH1A1 (0.41) | — | |
| SCHEMBL11501561 | 0.69 | CYP3A4 (0.30) | — | |
| SCHEMBL16475964 | 0.69 | LDHA (0.34) | — | |
| SCHEMBL11694243 | 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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5266674-A | Copolymers | PHILLIPS PETROLEUM COMPANY (US) | 1993-11-30 | — | — | US | disclosed |
| US-5264176-A | Washing with calcium salt, heating to remove water, molding, stretching, setting; heat resistance, melt stability | PHILLIPS PETROLEUM COMPANY (US) | 1993-11-23 | — | — | US | disclosed |
| US-5109102-A | Reacting alkali metal sulfide and dihaloaromatic ketone in polar organic compound, polymerizing, dehydrating, adding more ketone, polymerizing; high molecular weight | PHILLIPS PETROLEUM COMPANY (US) | 1992-04-28 | — | — | US | disclosed |
| US-5089596-A | From dihaloaromatic ketone, alkali metal sulfide, water, and polar organic compound | PHILLIPS PETROLEUM COMPANY (US) | 1992-02-18 | — | — | US | disclosed |
| US-5071944-A | Dihalaromatic ketone and alkali metal sulfide, heating to dehy drate | PHILLIPS PETROLEUM COMPANY (US) | 1991-12-10 | — | — | US | disclosed |
| EP-0450635-A2 | Process for preparing branched poly(arylene sulfide ketone) | PHILLIPS PETROLEUM COMPANY (US) | 1991-10-09 | — | — | EP | disclosed |
| US-5023315-A | Reacting dihaloaromatic component with complex of lactams, alkali hydroxide and sulfur source, such as alkali metal bisulfide, thiolactam or hydrogen sulfide; whiteness, purity | PHILLIPS PETEROLEUM COMPANY (US) | 1991-06-11 | — | — | US | disclosed |
| US-5003033-A | Engineering thermoplastics for films, molding materials and composites | PHILLIPS PETROLEUM COMPANY (US) | 1991-03-26 | — | — | US | disclosed |
| EP-0385299-A1 | Production of aromatic sulfide/ketone Polymers | PHILLIPS PETROLEUM COMPANY (US) | 1990-09-05 | — | — | EP | disclosed |
| EP-0306884-A1 | Production of aromatic sulfide/ketone polymers | PHILLIPS PETROLEUM COMPANY (US) | 1989-03-15 | — | — | EP | disclosed |
| US-4795799-A | FROM DIHALOAROMATIC KETONE AND ALKALI METAL HYDROSULFIDE | PHILLIPS PETROLEUM COMPANY (US) | 1989-01-03 | — | — | US | disclosed |