⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL17262949 | 0.98 | ALDH1A1 (0.61) | — | |
| SCHEMBL669513 | 0.77 | — | — | |
| SCHEMBL28793913 | 0.77 | — | — | |
| SCHEMBL1555508 | 0.77 | — | — | |
| SCHEMBL157526 | 0.77 | — | — | |
| SCHEMBL28411413 | 0.77 | ALDH1A1 (0.63) | — | |
| SCHEMBL17262642 | 0.77 | — | — | |
| Aes-103 SCHEMBL31307749 | 0.77 | — | — | |
| SCHEMBL13226970 | 0.77 | — | — | |
| SCHEMBL14157308 | 0.77 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-11180937-A | — | — | None | — | — | JP | disclosed |
| WO-2020034062-A1 | PROCESS FOR THE REDUCTIVE AMINATION OF A CARBONYL COMPOUND | RHODIA OPERATIONS (FR) | 2020-02-20 | — | — | WO | disclosed |
| WO-2020034057-A1 | PROCESS FOR REDUCTIVE AMINATION OF α, β-UNSATURATED KETONE | RHODIA OPERATIONS (FR) | 2020-02-20 | — | — | WO | disclosed |
| WO-2020034058-A1 | PROCESS FOR REDUCTIVE AMINATION OF α,β-UNSATURATED CARBONYL COMPOUND | RHODIA OPERATIONS (FR) | 2020-02-20 | — | — | WO | disclosed |
| US-10407547-B2 | Methods of producing compounds from 5-(halomethyl)furfural | MICROMIDAS, INC. (US) | 2019-09-10 | — | — | US | disclosed |
| US-10407547-B2 | Methods of producing compounds from 5-(halomethyl)furfural | MICROMIDAS, INC. (US) | 2019-09-10 | — | — | US | disclosed |
| EP-3381474-A1 | HISTONE DEACETYLASE INHIBITORS-BASED ANTIBODY DRUG CONJUGATES (ADCS) AND USE IN THERAPY | Alfasigma S.p.A. (IT) | 2018-10-03 | — | — | EP | disclosed |
| EP-2781961-B1 | TONER FOR ELECTROSTATIC IMAGE DEVELOPMENT, PRODUCTION METHOD OF THE TONER AND IMAGE FORMATION METHOD | KONICA MINOLTA INC (JP) | 2017-12-20 | — | — | EP | disclosed |
| US-9637463-B2 | Utilizing a multiphase reactor for the conversion of biomass to produce substituted furans | MICROMIDAS, INC. (US) | 2017-05-02 | — | — | US | disclosed |
| US-20170081470-A1 | METHODS OF PRODUCING COMPOUNDS FROM 5-(HALOMETHYL)FURFURAL | MICROMIDAS, INC. (US) | 2017-03-23 | — | — | US | disclosed |
| US-20170081470-A1 | METHODS OF PRODUCING COMPOUNDS FROM 5-(HALOMETHYL)FURFURAL | MICROMIDAS, INC. (US) | 2017-03-23 | — | — | US | disclosed |
| US-20170081470-A1 | METHODS OF PRODUCING COMPOUNDS FROM 5-(HALOMETHYL)FURFURAL | MICROMIDAS, INC. (US) | 2017-03-23 | — | — | US | disclosed |
| EP-3142997-A1 | METHODS OF PRODUCING COMPOUNDS FROM 5-(HALOMETHYL)FURFURAL | Micromidas, Inc. (US) | 2017-03-22 | — | — | EP | disclosed |
| WO-2015175528-A1 | METHODS OF PRODUCING COMPOUNDS FROM 5-(HALOMETHYL)FURFURAL | MICROMIDAS, INC. (US) | 2015-11-19 | — | — | WO | disclosed |
| WO-2015175528-A1 | METHODS OF PRODUCING COMPOUNDS FROM 5-(HALOMETHYL)FURFURAL | MICROMIDAS, INC. (US) | 2015-11-19 | — | — | WO | disclosed |
| EP-2781961-A1 | TONER FOR ELECTROSTATIC IMAGE DEVELOPMENT, PRODUCTION METHOD OF THE TONER AND IMAGE FORMATION METHOD | Konica Minolta, Inc. (JP) | 2014-09-24 | — | — | EP | disclosed |
| WO-2012004069-A1 | PROCESS FOR PRODUCING 2,5-DIFORMYLFURAN AND DERIVATIVES THEREOF | EVONIK DEGUSSA GMBH (DE) | 2012-01-12 | — | — | WO | disclosed |
| JP-H11180937-A | PREPARATION OF 5-AMINOLEVULINIC ACID | NOGUCHI INST | 1999-07-06 | — | — | JP | disclosed |