⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6718213 | 0.97 | TDP1 (0.62) | — | |
| SCHEMBL6721778 | 0.97 | — | — | |
| SCHEMBL442540 | 0.92 | — | — | |
| SCHEMBL40685 | 0.79 | — | — | |
| SCHEMBL28189336 | 0.79 | TDP1 (1.00) | — | |
| Ethane SCHEMBL27843578 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL5701908 | 0.77 | — | — | |
| SCHEMBL139711 | 0.74 | — | — | |
| SCHEMBL16816939 | 0.74 | HIF1A (0.82) | — | |
| SCHEMBL30678314 | 0.74 | — | — |
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 23 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105785048-B | Based on the nearly overall Protein quantitative analysis method with heavy label of light isotope | 同济大学 | 2017-07-28 | — | — | CN | claimed |
| CN-105785048-A | Global protein quantitative analysis method based on light isotope and isobar labeling | 同济大学 | 2016-07-20 | — | — | CN | claimed |
| CN-105785048-B | Based on the nearly overall Protein quantitative analysis method with heavy label of light isotope | 同济大学 | 2017-07-28 | — | — | CN | disclosed |
| CN-105785048-A | Global protein quantitative analysis method based on light isotope and isobar labeling | 同济大学 | 2016-07-20 | — | — | CN | disclosed |
| US-20110028746-A1 | METHOD FOR THE DECARBOXYLATIVE HYDROFORMYLATION OF ALPHA, BETA- UNSATURATED CARBOXYLIC ACIDS | BASF SE (DE) | 2011-02-03 | — | — | US | disclosed |
| EP-2268397-A1 | METHOD FOR THE DECARBOXYLATIVE HYDROFORMYLATION OF , ALPHA, BETA -UNSATURATED CARBOXYLIC ACIDS | BASF SE (DE) | 2011-01-05 | — | — | EP | disclosed |
| WO-2009118341-A1 | METHOD FOR THE DECARBOXYLATIVE HYDROFORMYLATION OF α,β-UNSATURATED CARBOXYLIC ACIDS | BASF SE (DE) | 2009-10-01 | — | — | WO | disclosed |
| US-20040097728-A1 | Method for producing anellated tetrahydro-{1h}-triazoles | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-20 | — | — | US | disclosed |
| US-6737544-B1 | HEATING ABOVE MELTING POINT | BASF AKTIENGESELLSCHAFT (DE) | 2004-05-18 | — | — | US | disclosed |
| US-6639070-B1 | 4-substituted 1,3,4-oxadiazines; herbicides | BASF AKTIENGESELLSCHAFT (DE) | 2003-10-28 | — | — | US | disclosed |
| EP-1187819-B1 | N-SUBSTITUTED PERHYDRO DIAZINE | BASF AG (DE) | 2003-07-23 | — | — | EP | disclosed |
| WO-2002020531-A2 | METHOD FOR PRODUCING ANELLATED TETRAHYDRO-[1H]-TRIAZOLES | BASF AKTIENGESELLSCHAFT (DE) | 2002-03-14 | — | — | WO | disclosed |
| EP-0835248-B1 | 1-AMINO-3-BENZYLURACILS | BASF AG (DE) | 2001-02-21 | — | — | EP | disclosed |
| WO-2001000600-A1 | N-SUBSTITUTED PERHYDRO DIAZINE | BASF AKTIENGESELLSCHAFT (DE) | 2001-01-04 | — | — | WO | disclosed |
| WO-2001000602-A1 | SUBSTITUTED UREAS | BASF AKTIENGESELLSCHAFT (DE) | 2001-01-04 | — | — | WO | disclosed |
| US-6150303-A | Substituted 3-phenylisoxazolines | BASF AKTIENGESELLSCHAFT (DE) | 2000-11-21 | — | — | US | disclosed |
| EP-0891336-A1 | SUBSTITUTED 1-METHYL-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1999-01-20 | — | — | EP | disclosed |
| EP-0835248-A1 | 1-AMINO-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1998-04-15 | — | — | EP | disclosed |
| WO-1997035845-A1 | SUBSTITUTED 1-METHYL-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1997-10-02 | — | — | WO | disclosed |
| WO-1997001543-A1 | 1-AMINO-3-BENZYLURACILS | BASF AKTIENGESELLSCHAFT (DE) | 1997-01-16 | — | — | WO | disclosed |