⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL855253 | 0.78 | — | — | |
| SCHEMBL25418137 | 0.75 | MEN1 (0.36) | — | |
| SCHEMBL28171883 | 0.70 | — | — | |
| SCHEMBL11519786 | 0.70 | CYP1A2 (0.30) | — | |
| SCHEMBL8577284 | 0.70 | CYP1A2 (0.30) | — | |
| SCHEMBL9073132 | 0.70 | CYP1A2 (0.30) | — | |
| SCHEMBL13892957 | 0.70 | EPHX1 (0.35) | — | |
| SCHEMBL8577287 | 0.70 | CYP1A2 (0.30) | — | |
| SCHEMBL11519789 | 0.70 | CYP1A2 (0.30) | — | |
| SCHEMBL14914504 | 0.69 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0268704-B1 | COLOUR PHOTOGRAHIC MOTION PICTURE ELEMENT | AGFA-GEVAERT N.V. (BE) | 1991-09-11 | — | — | EP | claimed |
| EP-2791099-B1 | PRODUCTION OF ACETIC ACID WITH ENHANCED CATALYST STABILITY | CELANESE INT CORP (US) | 2017-02-01 | — | — | EP | disclosed |
| US-8916727-B2 | Production of acetic acid with enhanced catalyst stability | CELANESE INTERNATIONAL CORPORATION (US) | 2014-12-23 | — | — | US | disclosed |
| EP-2791099-A1 | PRODUCTION OF ACETIC ACID WITH ENHANCED CATALYST STABILITY | Celanese International Corporation (US) | 2014-10-22 | — | — | EP | disclosed |
| US-20130184491-A1 | Production of Acetic Acid with Enhanced Catalyst Stability | CELANESE INTERNATIONAL CORPORATION (US) | 2013-07-18 | — | — | US | disclosed |
| WO-2013090720-A1 | PRODUCTION OF ACETIC ACID WITH ENHANCED CATALYST STABILITY | CELANESE INTERNATIONAL CORPORATION (US) | 2013-06-20 | — | — | WO | disclosed |
| EP-0501801-B1 | Process for preparing high molecular weight organopolysiloxanes | SHINETSU CHEMICAL CO (JP) | 1996-05-08 | — | — | EP | disclosed |
| US-5449847-A | Selective conversion of benzene to tercyclohexane | MOBIL OIL CORPORATION (US) | 1995-09-12 | — | — | US | disclosed |
| US-5212274-A | PROCESS FOR PREPARING HIGH MOLECULAR WEIGHT ORGANOPOLYSILOXANES | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1993-05-18 | — | — | US | disclosed |
| EP-0501801-A2 | Process for preparing high molecular weight organopolysiloxanes | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 1992-09-02 | — | — | EP | disclosed |
| EP-0268704-B1 | COLOUR PHOTOGRAHIC MOTION PICTURE ELEMENT | AGFA-GEVAERT N.V. (BE) | 1991-09-11 | — | — | EP | disclosed |