⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL24085378 | 0.77 | — | — | |
| SCHEMBL7628488 | 0.77 | — | — | |
| SCHEMBL402127 | 0.75 | — | — | |
| SCHEMBL14395838 | 0.75 | — | — | |
| SCHEMBL23158234 | 0.75 | — | — | |
| SCHEMBL26216377 | 0.75 | — | — | |
| SCHEMBL15947371 | 0.75 | — | — | |
| Maleic Hydrazide SCHEMBL55070 | 0.74 | CYP1A2 (0.44) | — | |
| Maleic Hydrazide SCHEMBL1534936 | 0.74 | CYP1A2 (0.44) | — | |
| Maleic Hydrazide SCHEMBL466482 | 0.74 | CYP1A2 (0.44) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1241996-A | Fluorobutenic acid hydrazides | BAYER AG (DE) | 2000-01-19 | — | — | CN | disclosed |
| EP-0846101-A1 | FLUOROBUTENIC ACID HYDRAZIDES | BAYER AG (DE) | 1998-06-10 | — | — | EP | disclosed |
| EP-0846101-A1 | FLUOROBUTENIC ACID HYDRAZIDES | BAYER AG (DE) | 1998-06-10 | — | — | EP | disclosed |
| WO-1997007091-A1 | FLUOROBUTENIC ACID HYDRAZIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-02-27 | — | — | WO | disclosed |
| WO-1997007091-A1 | FLUOROBUTENIC ACID HYDRAZIDES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-02-27 | — | — | WO | disclosed |
| WO-1997002238-A1 | FLUOROBUTENOIC ACID HYDRAZONES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-01-23 | — | — | WO | disclosed |
| WO-1997002238-A1 | FLUOROBUTENOIC ACID HYDRAZONES | BAYER AKTIENGESELLSCHAFT (DE) | 1997-01-23 | — | — | WO | disclosed |