⚠ 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 | |
|---|---|---|---|---|
| Isobutanol SCHEMBL27712265 | 1.00 | TSHR (0.90) | — | |
| Isobutanol SCHEMBL28999936 | 1.00 | TSHR (0.90) | — | |
| Isobutanol SCHEMBL9014448 | 0.95 | — | — | |
| Isobutanol SCHEMBL18695451 | 0.95 | — | — | |
| Isobutanol SCHEMBL969 | 0.95 | — | — | |
| Isobutanol SCHEMBL175952 | 0.95 | TSHR (1.00) | — | |
| Isobutanol SCHEMBL11800894 | 0.95 | TSHR (1.00) | — | |
| Isobutanol SCHEMBL23887407 | 0.90 | — | — | |
| Isobutanol SCHEMBL2277484 | 0.90 | — | — | |
| Isobutanol SCHEMBL1308019 | 0.90 | TSHR (0.90) | — |
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 54 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1996016667-A1 | COSMETIC COMPOSITIONS COMPRISING PILOCARPUS JABORANDI, ALOE VERA EXTRACTS | PVP SOCIEDADE ANÔNIMA (BR) | 1996-06-06 | — | — | WO | claimed |
| US-4430310-A | METHANOL, PROPANOL OR BUTANOL; PRECIPITATION, SODIUM CARBONATE AND SULFATE | KAISER ALUMINUM & CHEMICAL CORPORATION (US) | 1984-02-07 | — | — | US | claimed |
| CN-112206788-B | Composition, preparation method and application of catalyst for preparing isobutanol from synthesis gas | 内蒙古大学 | 2023-08-29 | — | — | CN | disclosed |
| JP-2023055530-A | Foaming agent for cement composition | 第一工業製薬株式会社 | 2023-04-18 | — | — | JP | disclosed |
| EP-3239165-B1 | COMPOSITION CONTAINING NITROGEN HETEROCYCLIC HEXAPEPTIDE PRECURSOR AND PREPARATION METHOD AND APPLICATION THEREOF | SHANGHAI TECHWELL BIOPHARM CO (CN) | 2019-10-09 | — | — | EP | disclosed |
| CN-105324172-B | For manufacturing the technique of methacrylate | 罗门哈斯公司 | 2019-05-31 | — | — | CN | disclosed |
| CN-104861043-B | A kind of composition of cyclic peptide compound and its preparation method and application | 上海天伟生物制药有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-104861044-B | A kind of solvate of cyclic peptide compound and its preparation method and application | 上海天伟生物制药有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-104788545-B | A kind of crystalline powder of cyclic peptide compound and its preparation method and application | 上海天伟生物制药有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-104877012-B | Crystal of cyclic peptide compound and preparation method and application thereof | 上海天伟生物制药有限公司 | 2019-03-01 | — | — | CN | disclosed |
| CN-108707066-A | A method of using methanol/ethanol as Material synthesis isobutylaldehyde and/or isobutanol | 西安元创化工科技股份有限公司 | 2018-10-26 | — | — | CN | disclosed |
| WO-2007131236-A2 | A GAS HOMOGENIZATION SYSTEM | PLASCO ENERGY GROUP INC. (CA) | 2007-11-15 | — | — | WO | disclosed |
| CN-1295619-A | Salicylate pathway gene and its use for induction of resistance in plants | JENNIC MOGEN N V (NL) | 2001-05-16 | — | — | CN | disclosed |
| US-5786460-A | PEPTIDE ANTIBIOTIC PRODUCED BY PSEUDOMONAS CEPACIA | CHEIL FOODS & CHEMICALS, INC. (KR) | 1998-07-28 | — | — | US | disclosed |
| US-4407920-A | XEROGRAPHY | XEROX CORPORATION (US) | 1983-10-04 | — | — | US | disclosed |
| EP-0069133-A1 | PHOTO SETTING COMPOSITION FOR COATING SUBSTRATES WITH AN ABRASION-RESISTANT TRANSPARENT OR TRANSLUCENT FILM. | BATTELLE DEVELOPMENT CORP (US) | 1983-01-12 | — | — | EP | disclosed |
| US-4346179-A | CATALYTIC HYDROGENATION AND HOMOLOGATION | INSTITUT FRANCAIS DU PETROLE (FR) | 1982-08-24 | — | — | US | disclosed |
| WO-1982002403-A1 | PHOTO SETTING COMPOSITION FOR COATING SUBSTRATES WITH AN ABRASION-RESISTANT TRANSPARENT OR TRANSLUCENT FILM | NGUYEN TAO VAN | 1982-07-22 | — | — | WO | disclosed |
| US-4191804-A | CONDENSATE OF A SILANETRIOL, AMINO RESIN | TECHSIGHT CORP. (US) | 1980-03-04 | — | — | US | disclosed |
| US-3996174-A | Process for the manufacture of heat-curable synthetic resins which can be diluted with water and are suitable for the electrophoretic coating process | HOECHST AKTIENGESELLSCHAFT (DT) | 1976-12-07 | — | — | US | disclosed |