⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3328089 | 1.00 | — | — | |
| SCHEMBL17335808 | 0.84 | ALDH1A1 (0.50) | — | |
| SCHEMBL6880598 | 0.78 | — | — | |
| SCHEMBL3322738 | 0.77 | ALDH1A1 (0.42) | — | |
| SCHEMBL3322735 | 0.77 | ALDH1A1 (0.42) | — | |
| SCHEMBL3107600 | 0.76 | ALDH1A1 (0.48) | — | |
| SCHEMBL11704897 | 0.76 | LMNA (0.46) | — | |
| SCHEMBL1426861 | 0.76 | BLM (0.41) | — | |
| SCHEMBL20641014 | 0.75 | — | — | |
| SCHEMBL6384594 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103483201-A | Synthetic method of (R)-2-methyl-4-nitro-1-butanol | CHEMFUTURE PHARMATECH LTD | 2014-01-01 | — | — | CN | claimed |
| US-8637696-B2 | Methods for preparing amides and amino acids | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2014-01-28 | — | — | US | disclosed |
| CN-103483201-A | Synthetic method of (R)-2-methyl-4-nitro-1-butanol | CHEMFUTURE PHARMATECH LTD | 2014-01-01 | — | — | CN | disclosed |
| CN-103483201-A | Synthetic method of (R)-2-methyl-4-nitro-1-butanol | CHEMFUTURE PHARMATECH LTD | 2014-01-01 | — | — | CN | disclosed |
| CN-103483201-A | Synthetic method of (R)-2-methyl-4-nitro-1-butanol | CHEMFUTURE PHARMATECH LTD | 2014-01-01 | — | — | CN | disclosed |
| US-20130030210-A1 | METHODS FOR PREPARING AMIDES AND AMINO ACIDS | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2013-01-31 | — | — | US | disclosed |
| US-8338620-B2 | Methods for the production of C-8 lactam lactone compounds | NOVARTIS AG (CH) | 2012-12-25 | — | — | US | disclosed |
| US-8269039-B2 | Amino acids and catalytic preparatory methods | WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2012-09-18 | — | — | US | disclosed |
| US-20100130749-A1 | METHODS | NODEN PHARMA DAC (IE) | 2010-05-27 | — | — | US | disclosed |
| US-20090264676-A1 | Amino acids and catalytic preparatory methods | WARF - WISCONSIN ALUMNI RESEARCH FOUNDATION (US) | 2009-10-22 | — | — | US | disclosed |
| US-4393149-A | Method of preparing polyurethane foams using imidazolines as catalysts | ANGUS CHEMICAL COMPANY (US) | 1983-07-12 | — | — | US | disclosed |