⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11136037 | 0.81 | TSHR (0.33) | — | |
| Hydrochloric Acid SCHEMBL11381188 | 0.77 | — | — | |
| SCHEMBL2306569 | 0.77 | — | — | |
| SCHEMBL11599837 | 0.67 | — | — | |
| SCHEMBL10392477 | 0.64 | MAPT (0.31) | — | |
| SCHEMBL538777 | 0.64 | — | — | |
| SCHEMBL4786109 | 0.64 | — | — | |
| SCHEMBL2354584 | 0.63 | — | — | |
| SCHEMBL11094464 | 0.63 | — | — | |
| SCHEMBL11196423 | 0.63 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5110975-A | ISOCYANATOALKYL SULPHONATES AND A PROCESS FOR THEIR PREPARATION | BAYER AKTIENGESELLSCHAFT (DE) | 1992-05-05 | — | — | US | disclosed |
| US-4411752-A | Preparation of 1-monochloroethylcarbamyl chloride | BASF AKTIENGESELLSCHAFT (DE) | 1983-10-25 | — | — | US | disclosed |
| US-4297300-A | Novel α-haloalkylcarbamic acid halides, and a process for the preparation of α-haloalkylcarbamic acid halides | BASF AKTIENGESELLSCHAFT (DE) | 1981-10-27 | — | — | US | disclosed |
| US-4235814-A | HYDROHALOGENATION OF N-TERT-ALKYL-N-1-ALKENYLCARBAMYL HALIDE WITH HYDROGEN HALIDE | BASF AKTIENGESELLSCHAFT (DE) | 1980-11-25 | — | — | US | disclosed |
| US-4235814-A | HYDROHALOGENATION OF N-TERT-ALKYL-N-1-ALKENYLCARBAMYL HALIDE WITH HYDROGEN HALIDE | BASF AKTIENGESELLSCHAFT (DE) | 1980-11-25 | — | — | US | disclosed |
| US-4189446-A | FROM VINYL ISOCYANATE AND HYDROGEN HALIDE | BASF AKTIENGESELLSCHAFT (DE) | 1980-02-19 | — | — | US | disclosed |