⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11477832 | 0.71 | — | — | |
| SCHEMBL9680012 | 0.70 | — | — | |
| SCHEMBL14068103 | 0.68 | — | — | |
| SCHEMBL14077164 | 0.68 | — | — | |
| SCHEMBL5935508 | 0.66 | — | — | |
| SCHEMBL19264693 | 0.66 | — | — | |
| SCHEMBL15678385 | 0.64 | — | — | |
| SCHEMBL1118870 | 0.64 | — | — | |
| SCHEMBL4612040 | 0.64 | TSHR (0.39) | — | |
| SCHEMBL10518951 | 0.62 | TAS2R46 (0.41) | — |
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 14 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070219383-A1 | Method for Reducing Alkyne Compuonds | BASF AKTIENGESELLSCHAFT (DE) | 2007-09-20 | — | — | US | disclosed |
| EP-1718589-A2 | METHOD FOR PRODUCING ASTAXANTHIN AND CANTHAXANTHIN INTERMEDIATE PRODUCTS | BASF AKTIENGESELLSCHAFT (DE) | 2006-11-08 | — | — | EP | disclosed |
| WO-2005056507-A2 | METHOD FOR PRODUCING ASTAXANTHIN AND CANTHAXANTHIN INTERMEDIATE PRODUCTS | BASF AKTIENGESELLSCHAFT (DE) | 2005-06-23 | — | — | WO | disclosed |
| US-20040195108-A1 | Method of producing oxocylohexyl or oxocyclohexylene derivatives | BOTZEM JORG (DE) | 2004-10-07 | — | — | US | disclosed |
| US-6747177-B2 | CHEMICAL INTERMEDIATE, OPTICALLY ACTIVE CYCLOHEXYLACETYLENEDIOL | BASF AKTIENGESELLSCHAFT (DE) | 2004-06-08 | — | — | US | disclosed |
| US-6743954-B2 | THERAPY FOR VISION DEFECTS | BASF AKTIENGESELLSCHAFT (DE) | 2004-06-01 | — | — | US | disclosed |
| US-6699911-B2 | PREPARATION OF CYCLOHEXENE DERIVATIVES INTERMEDIATES FOR CAROTINOIDS USING A MIXTURE OF ZINC AND A SALT OF AMMONIUM, COPPER, ALKALI METAL OR ALKALINE EARTH METAL AS REDUCING AGENT | BASF AKTIENGESELLSCHAFT (DE) | 2004-03-02 | — | — | US | disclosed |
| US-20040024264-A1 | Process for the preparation of meso-zeaxanthin | ERNST HANSGEORG (DE) | 2004-02-05 | — | — | US | disclosed |
| US-6590111-B2 | Reduction of alkyne compounds to cyclohexene derivatives using as reducing agent salt of hyposulfurous acid and/or hydroxymethanesulfinic acid | BASF AKTIENGESELLSCHAFT (DE) | 2003-07-08 | — | — | US | disclosed |
| US-20030092775-A1 | Process for the preparation of meso-zeaxanthin | BASF AKTIENGESELLSCHAFT (DE) | 2003-05-15 | — | — | US | disclosed |
| US-20030060639-A1 | Selective reduction of alkyne compounds | GRIMMER JOHANNES (DE) | 2003-03-27 | — | — | US | disclosed |
| US-20020045768-A1 | Catalytic reduction of alkyne compounds | BASF AKTIENGESELLSCHAFT (DE) | 2002-04-18 | — | — | US | disclosed |
| US-5625099-A | Preparation of astaxanthin, novel intermediates therefor and the preparation thereof | ERNST HANSGEORG (DE) | 1997-04-29 | — | — | US | disclosed |
| US-5455362-A | Preparation of astaxanthin novel intermediates therefor and the preparation thereof | BASF AKTIENGESELLSCHAFT (DE) | 1995-10-03 | — | — | US | disclosed |