⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6702150 | 0.84 | SPHK1 (0.34) | — | |
| SCHEMBL6684632 | 0.81 | GABRA1 (0.39) | — | |
| SCHEMBL6685905 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL30335334 | 0.72 | JAK2 (0.35) | — | |
| SCHEMBL11863751 | 0.66 | HTR1A (0.40) | — | |
| SCHEMBL16956096 | 0.65 | GABRA1 (0.45) | — | |
| SCHEMBL18790124 | 0.65 | HTR2C (0.46) | — | |
| SCHEMBL15577034 | 0.65 | ADRA2A (0.35) | — | |
| SCHEMBL15577022 | 0.64 | KDM4E (0.40) | — | |
| SCHEMBL16956094 | 0.63 | GABRA1 (0.39) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012047360-A1 | FUNCTIONALIZED POLYETHYLENE TEREPHTHALATE POLYMERS, FUNCTIONALIZED DERIVATIVE POLYMERS OF POLYETHYLENE TEREPHTHALATE, METHODS OF MAKING AND USING SAME | FELICE KRISTOPHER M (US) | 2012-04-12 | — | — | WO | disclosed |
| US-20040214959-A1 | Production of polymer compounds between polyester and diamine, a polymer compound and a structure including thereof | M&S RESEARCH AND DEVELOPMENT CO., LTD. (JP) | 2004-10-28 | — | — | US | disclosed |
| EP-1273628-A1 | MOLDING MATERIAL FOR ELECTRICAL AND ELECTRONIC PARTS | Mitsui Chemicals, Inc. (JP) | 2003-01-08 | — | — | EP | disclosed |
| US-6133406-A | CONDENSATION POLYMERIZATION TO FORM LOW MOLECULAR WEIGHT POLYAMIDE, THEN SOLID PHASE POLYMERIZATION TO INCREASE MOLECULAR WEIGHT TO YIELD HIGH MELTING, HEAT RESISTANT AROMATIC POLYAMIDE | MITSUI CHEMICALS, INC. (JP) | 2000-10-17 | — | — | US | disclosed |
| EP-0397531-B1 | Thermoplastic resin composition and use thereof | MITSUI PETROCHEMICAL IND (JP) | 1995-08-02 | — | — | EP | disclosed |
| EP-0406859-A2 | Process for producing a resin molded article having a metal plated layer thereon | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1991-01-09 | — | — | EP | disclosed |
| EP-0397531-A2 | Thermoplastic resin composition and use thereof | MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) | 1990-11-14 | — | — | EP | disclosed |