⚠ 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 | |
|---|---|---|---|---|
| Methyl Sorbate SCHEMBL26463541 | 1.00 | — | — | |
| Methyl Sorbate SCHEMBL166360 | 1.00 | — | — | |
| Methyl Sorbate SCHEMBL166359 | 1.00 | — | — | |
| Methyl Sorbate SCHEMBL14764128 | 1.00 | NFE2L2 (0.60) | — | |
| Methyl Sorbate SCHEMBL821214 | 1.00 | — | — | |
| Methyl Sorbate SCHEMBL7260200 | 0.97 | NFE2L2 (0.57) | — | |
| Methyl Sorbate SCHEMBL7260192 | 0.97 | NFE2L2 (0.57) | — | |
| SCHEMBL28552613 | 0.97 | NFE2L2 (0.57) | — | |
| Methyl Sorbate SCHEMBL7015053 | 0.93 | NFE2L2 (0.52) | — | |
| Methyl Sorbate SCHEMBL1408906 | 0.89 | NFE2L2 (0.48) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9073867-B2 | Process for preparing caprolactam and polyamides therefrom | Amyris, Inc. (US) | 2015-07-07 | — | — | US | disclosed |
| US-8815054-B2 | Methods for making fibrous paper structures utilizing waterborne shape memory polymers | THE PROCTER & GAMBLE COMPANY (US) | 2014-08-26 | — | — | US | disclosed |
| US-8415496-B2 | Biobased polyesters | Amyris, Inc. | 2013-04-09 | — | — | US | disclosed |
| US-20130085255-A1 | Process for Preparing Caprolactam and Polyamides Therefrom | Amyris, Inc. (US) | 2013-04-04 | — | — | US | disclosed |
| US-8367859-B2 | Cyclohexane 1,4 carboxylates | Amyris, Inc. (US) | 2013-02-05 | — | — | US | disclosed |
| US-8367858-B2 | Terephthalic and trimellitic based acids and carboxylate derivatives thereof | Amyris, Inc. (US) | 2013-02-05 | — | — | US | disclosed |
| US-20110288310-A1 | CYCLOHEXANE 1,4 CARBOXYLATES | DRATHS CORPORATION (US) | 2011-11-24 | — | — | US | disclosed |
| US-20110288263-A1 | BIOBASED POLYESTERS | DRATHS CORPORATION (US) | 2011-11-24 | — | — | US | disclosed |
| US-20110288311-A1 | NOVEL TEREPHTHALIC AND TRIMELLITIC BASED ACIDS AND CARBOXYLATE DERIVATIVES THEREOF | DRATHS CORPORATION (US) | 2011-11-24 | — | — | US | disclosed |
| US-20110282078-A1 | CYCLOHEXENE 1,4 -CARBOXYLATES | DRATHS CORPORATION (US) | 2011-11-17 | — | — | US | disclosed |
| US-20090214454-A1 | METHOD FOR SKIN WHITENING USING (2Z, 8Z) - MATRICARIA ACID METHYL ESTER | INHA-INDUSTRY PARTNERSHIP INSTITUTE (KR) | 2009-08-27 | — | — | US | disclosed |