⚠ 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 | |
|---|---|---|---|---|
| Acetic Acid SCHEMBL8327416 | 0.87 | — | — | |
| Acetamide SCHEMBL8008564 | 0.84 | — | — | |
| Bicarbonate SCHEMBL11226195 | 0.82 | — | — | |
| Acetic Acid SCHEMBL15570861 | 0.81 | — | — | |
| Acetic Acid SCHEMBL15571181 | 0.81 | — | — | |
| Acetone SCHEMBL28304157 | 0.80 | — | — | |
| Acetone SCHEMBL153745 | 0.76 | — | — | |
| Acetone SCHEMBL4909337 | 0.76 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL391390 | 0.76 | ALDH1A1 (0.60) | — | |
| Acetone SCHEMBL4414746 | 0.76 | ALDH1A1 (0.60) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6784324-B2 | Process for producing bisphenol A | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2004-08-31 | — | — | US | disclosed |
| US-20030212299-A1 | Process for producing bisphenol A | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2003-11-13 | — | — | US | disclosed |
| EP-1346973-A1 | PROCESS FOR PRODUCING BISPHENOL A | Idemitsu Petrochemical Co., Ltd. (JP) | 2003-09-24 | — | — | EP | disclosed |
| US-6608234-B2 | Process for producing bisphenol A | IDEMITSU PETROCHEMICAL CO., LTD. (JP) | 2003-08-19 | — | — | US | disclosed |
| US-20030013926-A1 | Process for producing bisphenol a | IDEMITSU KOSAN CO. LTD. (JP) | 2003-01-16 | — | — | US | disclosed |