⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11039521 | 0.85 | CA12 (0.56) | — | |
| SCHEMBL11039519 | 0.85 | CA12 (0.56) | — | |
| SCHEMBL11123571 | 0.84 | CASP2 (0.56) | — | |
| SCHEMBL11123570 | 0.84 | CASP2 (0.56) | — | |
| SCHEMBL1047030 | 0.78 | — | — | |
| SCHEMBL11876113 | 0.78 | — | — | |
| SCHEMBL184627 | 0.76 | — | — | |
| SCHEMBL17734071 | 0.76 | — | — | |
| SCHEMBL1414782 | 0.76 | — | — | |
| SCHEMBL6900518 | 0.76 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5633221-A | Silicone containing imidazoline compositions | MONA INDUSTRIES, INC. (US) | 1997-05-27 | — | — | US | claimed |
| US-4537752-A | TREATMENT WITH VANADIUM TO OXIDIZE HYDROGEN SULFIDE TO SULFUR | LINDE AKTIENGESELLSCHAFT (DE) | 1985-08-27 | — | — | US | disclosed |
| US-4526694-A | Acid-containing product for the treatment of moist wash in the mechanical clothes drier | HENKEL KOMMANDITGESELLSCHAFT (HENKEL KGAA) (DE) | 1985-07-02 | — | — | US | disclosed |
| US-4183981-A | FOR TUMBLE DRYING IN MECHANICAL DRIER | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) | 1980-01-15 | — | — | US | disclosed |
| US-4167594-A | AFTERTREATMENT, MULTILAYER BAG COMPRISING AN OPEN-CELLED ABSORBENT LAYER AND A PLASTIC FILM LAYER | HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN(HENKEL KGAA) (DE) | 1979-09-11 | — | — | US | disclosed |