⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5353136 | 0.82 | — | — | |
| SCHEMBL7600801 | 0.82 | — | — | |
| SCHEMBL4451509 | 0.81 | — | — | |
| SCHEMBL7079781 | 0.79 | — | — | |
| SCHEMBL5347827 | 0.78 | — | — | |
| SCHEMBL19460162 | 0.75 | EDNRB (0.30) | — | |
| SCHEMBL7195418 | 0.75 | — | — | |
| SCHEMBL6917190 | 0.75 | — | — | |
| SCHEMBL797373 | 0.74 | — | — | |
| SCHEMBL4453786 | 0.73 | — | — |
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-6300416-B1 | USEFUL AS TIRE SIDEWALL OR TIRE TREAD; STRENGTH PROPERTIES AND BENDING FATIGUE RESISTANCE AND LOW FUEL CONSUMPTION | MITSUI CHEMICALS, INC. (JP) | 2001-10-09 | — | — | US | disclosed |
| US-6015625-A | COMPOSITION CONTAINING ALPHA-OLEFIN/AROMATIC VINYL COMPOUND RANDOM COPOLYMER GRAFT MODIFIED WITH UNSATURATED CARBOXYLIC ACID OR DERIVATIVE | MITSUI CHEMICALS, INC. (JP) | 2000-01-18 | — | — | US | disclosed |
| EP-0896044-A1 | ADHESIVE RESIN COMPOSITION AND LAMINATE MADE USING THE SAME AS ADHESIVE LAYER | Mitsui Chemicals, Inc. (JP) | 1999-02-10 | — | — | EP | disclosed |
| EP-0893245-A1 | VULCANIZED MOLDING HAVING SURFACE DECORATIVE LAYER, PAINTED THERMOPLASTIC RESIN COMPOSITION, AND PAINTED ELASTOMER COMPOSITION | Mitsui Chemicals, Inc. (JP) | 1999-01-27 | — | — | EP | disclosed |
| EP-0889091-A1 | RUBBER COMPOSITIONS FOR TIRES | Mitsui Chemicals, Inc. (JP) | 1999-01-07 | — | — | EP | disclosed |