⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1685541 | 0.74 | — | — | |
| SCHEMBL28224644 | 0.68 | CYP1A2 (0.30) | — | |
| SCHEMBL9436871 | 0.68 | — | — | |
| SCHEMBL1025201 | 0.67 | ALDH1A1 (0.36) | — | |
| SCHEMBL6268796 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL9440324 | 0.64 | HTR2C (0.34) | — | |
| SCHEMBL8024877 | 0.64 | CYP1A2 (0.32) | — | |
| SCHEMBL8770717 | 0.64 | ALDH1A1 (0.32) | — | |
| SCHEMBL7941113 | 0.64 | — | — | |
| SCHEMBL4611403 | 0.64 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20020143126-A1 | Ethylene resin injection molded articles | TAKAHASHI MAMORU (JP) | 2002-10-03 | — | — | US | disclosed |
| US-6319961-B1 | ETHYLENE/ALPHA-OLEFIN COPOLYMER; DENSITY IS 0.880-0.940 G/CM3; MELT FLOW RATE AT 190 DEGREES C. UNDER A 2.16 KG LOAD IS 0.1-20 G/10 MIN | MITSUI CHEMICALS INC (JP) | 2001-11-20 | — | — | US | disclosed |