⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL134974 | 1.00 | — | — | |
| SCHEMBL28124307 | 0.97 | — | — | |
| SCHEMBL28717404 | 0.97 | — | — | |
| SCHEMBL28711857 | 0.97 | ALDH1A1 (0.35) | — | |
| Isobutyraldehyde SCHEMBL27940123 | 0.89 | GABRP (0.31) | — | |
| Acetaldehyde SCHEMBL27940990 | 0.89 | TAS1R3 (0.32) | — | |
| SCHEMBL11568243 | 0.79 | — | — | |
| SCHEMBL11568240 | 0.79 | — | — | |
| SCHEMBL13651705 | 0.79 | — | — | |
| SCHEMBL21490457 | 0.77 | ALDH1A1 (0.32) | — |
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 470 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11208367-B2 | Production method for p-xylene | ENEOS CORPORATION (JP) | 2021-12-28 | — | — | US | claimed |
| US-20210009488-A1 | PRODUCTION METHOD FOR P-XYLENE | ENEOS CORPORATION (JP) | 2021-01-14 | — | — | US | claimed |
| US-20210009487-A1 | PRODUCTION METHOD FOR P-XYLENE | ENEOS CORPORATION (JP) | 2021-01-14 | — | — | US | claimed |
| US-10889146-B2 | Tire object provided with an elastomer layer made of a thermoplastic elastomer in the form of an (A-b-(a-methylstyrene-co-B))n-b-C block copolymer | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2021-01-12 | — | — | US | claimed |
| WO-2019188602-A1 | PRODUCTION METHOD FOR P–XYLENE | ＪＸＴＧエネルギー株式会社 | 2019-10-03 | — | — | WO | claimed |
| WO-2019188605-A1 | PRODUCTION METHOD FOR P–XYLENE | ＪＸＴＧエネルギー株式会社 | 2019-10-03 | — | — | WO | claimed |
| US-20180043734-A1 | TIRE OBJECT PROVIDED WITH AN ELASTOMER LAYER MADE OF A THERMOPLASTIC ELASTOMER IN THE FORM OF AN (A-B-(A-METHYLSTYRENE-CO-B))N-B-C BLOCK COPOLYMER | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2018-02-15 | — | — | US | claimed |
| EP-3268401-A1 | TYRE OBJECT PROVIDED WITH AN ELASTOMER LAYER MADE OF A THERMOPLASTIC ELASTOMER IN THE FORM OF AN (A-B(A-CO-B))N-B-C BLOCK COPOLYMER | Compagnie Générale des Etablissements Michelin (FR) | 2018-01-17 | — | — | EP | claimed |
| WO-2016142379-A1 | TYRE OBJECT PROVIDED WITH AN ELASTOMER LAYER MADE OF A THERMOPLASTIC ELASTOMER IN THE FORM OF AN (A-B-(Α-METHYLSTYRENE-CO-B))N-B-C BLOCK COPOLYMER | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2016-09-15 | — | — | WO | claimed |
| WO-2016142390-A1 | TYRE OBJECT PROVIDED WITH AN ELASTOMER LAYER SEALED AGAINST INFLATION GASES MADE OF A BLEND OF THERMOPLASTIC ELASTOMERS IN THE FORM OF BLOCK COPOLYMERS | COMPAGNIE GENERALE DES ETABLISSEMENTS MICHELIN (FR) | 2016-09-15 | — | — | WO | claimed |
| WO-1999057167-A1 | GRAFTED COPOLYMER USEFUL FOR PREPARING PRESSURE-SENSITIVE ADHESIVE COMPOSITIONS | RHODIA CHIMIE (FR) | 1999-11-11 | — | — | WO | claimed |
| EP-0746572-B1 | NEW FUNCTIONALIZED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORP (US) | 1999-04-28 | — | — | EP | claimed |
| EP-0827423-A1 | FUNCTIONALIZED CHAIN EXTENDED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORPORATION (US) | 1998-03-11 | — | — | EP | claimed |
| WO-1997024377-A1 | FUNCTIONALIZED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORPORATION (US) | 1997-07-10 | — | — | WO | claimed |
| EP-0746572-A4 | NEW FUNCTIONALIZED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORP (US) | 1997-03-26 | — | — | EP | claimed |
| EP-0746572-A1 | NEW FUNCTIONALIZED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORPORATION (US) | 1996-12-11 | — | — | EP | claimed |
| WO-1996035509-A1 | FUNCTIONALIZED CHAIN EXTENDED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORPORATION (US) | 1996-11-14 | — | — | WO | claimed |
| US-5567774-A | USING SODIUM, POTASSIUM, OR LITHIUM HYDROCARBYL ETHER COMPOUNDS AS INITIATORS | FMC CORPORATION (US) | 1996-10-22 | — | — | US | claimed |
| US-5565526-A | Functionalized initiators for anionic polymerization | FMC CORPORATION (US) | 1996-10-15 | — | — | US | claimed |
| WO-1995022566-A1 | NEW FUNCTIONALIZED INITIATORS FOR ANIONIC POLYMERIZATION | FMC CORPORATION (US) | 1995-08-24 | — | — | WO | claimed |