⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19275006 | 0.81 | ALDH1A1 (0.39) | — | |
| SCHEMBL10478110 | 0.77 | LMNA (0.44) | — | |
| SCHEMBL6538254 | 0.77 | CHRM3 (0.38) | — | |
| (-)-Methyl Shikimate SCHEMBL15983807 | 0.77 | ALDH1A1 (0.36) | — | |
| SCHEMBL15983808 | 0.75 | ALDH1A1 (0.35) | — | |
| SCHEMBL15983812 | 0.74 | MAPT (0.35) | — | |
| SCHEMBL15929789 | 0.74 | CHRM3 (0.37) | — | |
| SCHEMBL15929795 | 0.74 | SLC6A3 (0.33) | — | |
| SCHEMBL11313805 | 0.74 | CHRM3 (0.36) | — | |
| SCHEMBL1716907 | 0.74 | CHRM3 (0.36) | — |
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-5795567-A | HYDROFORMYLATION FOLLOWED BY REDUCTIVE AMINATION AND ATTACHING A CHLOROORGANOSILYL COMPOUND; DRUG DELIVERTYSYSTEMS | MONSANTO COMPANY (US) | 1998-08-18 | — | — | US | disclosed |
| US-5693319-A | HYDROFORMYLATING OLEFINIC-CONTAINING POLYMER IN PRESENCE OF CATALYST, REDUCTIVELY AMINATING | MONSANTO COMPANY (US) | 1997-12-02 | — | — | US | disclosed |
| US-5676939-A | CROSSLINKING; CONTROLLING DENSITY; DRUG DELIVERY | MONSANTO COMPANY (US) | 1997-10-14 | — | — | US | disclosed |
| EP-0502839-B1 | Functionalized polymers | MONSANTO CO (US) | 1997-07-09 | — | — | EP | disclosed |
| EP-0540670-B1 | METHOD FOR PREPARATION OF CROSSLINKED POLYAMINES | MONSANTO CO (US) | 1996-03-20 | — | — | EP | disclosed |
| US-5474767-A | Crosslinked; controlled density; water insoluble; residual unsaturation | MONSANTO COMPANY (US) | 1995-12-12 | — | — | US | disclosed |
| US-5294675-A | A-C copoly;hydroformylation | MONSANTO COMPANY (US) | 1994-03-15 | — | — | US | disclosed |
| US-5232989-A | Hydroformylation of polyoefins, reduction to hydroxyl groups, reacting with diisocyanate | MONSANTO COMPANY (US) | 1993-08-03 | — | — | US | disclosed |
| EP-0540670-A1 | NOVEL POLYAMINES AND METHOD FOR PREPARATION THEREOF. | MONSANTO CO (US) | 1993-05-12 | — | — | EP | disclosed |
| EP-0502839-A2 | Functionalized polymers | MONSANTO COMPANY (US) | 1992-09-09 | — | — | EP | disclosed |
| WO-1992001730-A1 | NOVEL POLYAMINES AND METHOD FOR PREPARATION THEREOF | MONSANTO COMPANY (US) | 1992-02-06 | — | — | WO | disclosed |