⚠ 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 | |
|---|---|---|---|---|
| Isobutane SCHEMBL7910872 | 1.00 | — | — | |
| Isobutane SCHEMBL11409032 | 1.00 | — | — | |
| Benzene SCHEMBL28758326 | 0.88 | — | — | |
| SCHEMBL583176 | 0.86 | ALDH1A1 (0.42) | — | |
| SCHEMBL4638041 | 0.86 | ALDH1A1 (0.46) | — | |
| SCHEMBL27839719 | 0.84 | — | — | |
| SCHEMBL28809843 | 0.82 | — | — | |
| SCHEMBL9687998 | 0.82 | — | — | |
| Isopropyl Alcohol SCHEMBL29031793 | 0.82 | ALDH1A1 (0.50) | — | |
| SCHEMBL27540653 | 0.82 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-112521877-A | Decorative film having excellent adhesion to curved surface | 永佑有限公司 | 2021-03-19 | — | — | CN | disclosed |
| US-7510811-B2 | Toner for developing electrostatic image and resin particle disperision solution for toner for developing electrostatic image | FUJI XEROX CO., LTD. (JP) | 2009-03-31 | — | — | US | disclosed |
| US-20060257777-A1 | Toner for developing electrostatic image and resin particle dispersion solution for toner for developing electrostatic image | FUJI XEROX CO., LTD. (JP) | 2006-11-16 | — | — | US | disclosed |
| US-20010046555-A1 | Method of coating metal strips | LESSMEISTER PETER (US) | 2001-11-29 | — | — | US | disclosed |
| US-20010002274-A1 | METAL STRIP COATING PROCESS | BASF COATINGS AKTIENGESELLSCHAFT (DE) | 2001-05-31 | — | — | US | disclosed |
| US-6054242-A | BINDER, COLORANT AND CARBODIIMIDE-CROSSLINKED POLYESTER BASED ON THE REACTION OF A POLYESTER WITH A POLYCARBODIIMIDE RESIN HAVING A CARBODIIMIDE GROUP-N=C=N-, AND A LOW MELTING POINT COMPOUND; OFFSET RESISTANCE, SHELFLIFE | TOMOGAWA PAPER CO., LTD. (JP) | 2000-04-25 | — | — | US | disclosed |
| US-5905132-A | POLYURETHANE RESIN BINDERS | BASF COATINGS AG (DE) | 1999-05-18 | — | — | US | disclosed |
| US-5840799-A | PIGMENT COLOR IN POLYACRYLATE OR POLYMETHACRYLATE RESIN WITH SOLVENT | BASF LACKE+FARBEN, AG (DE) | 1998-11-24 | — | — | US | disclosed |
| US-5334420-A | Acrylated polyurethane | BASF LACKE & FARBEN AKTIENGESELLSCHAFT (DE) | 1994-08-02 | — | — | US | disclosed |