⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7037854 | 0.77 | CA4 (0.38) | — | |
| SCHEMBL7449805 | 0.73 | ALDH1A1 (0.33) | — | |
| SCHEMBL20072746 | 0.73 | — | — | |
| SCHEMBL11742833 | 0.73 | — | — | |
| Dimethyl Acetylphosphonate SCHEMBL2459022 | 0.71 | — | — | |
| SCHEMBL11681819 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL11625632 | 0.71 | — | — | |
| SCHEMBL27742533 | 0.69 | LMNA (0.32) | — | |
| SCHEMBL10508956 | 0.69 | CA12 (0.48) | — | |
| SCHEMBL4610608 | 0.69 | ALDH1A1 (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4017297-A | CARBAMOYLPHOSPHONATES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-04-12 | — | — | US | claimed |
| US-4048156-A | PLANT GROWTH REGULATORS | E. I DU PONT DE NEMOURS AND COMPANY (US) | 1977-09-13 | — | — | US | disclosed |
| US-4017297-A | CARBAMOYLPHOSPHONATES | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1977-04-12 | — | — | US | disclosed |
| US-3997544-A | Plant growth regulant carbamoylphosphonates | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-12-14 | — | — | US | disclosed |
| US-3981870-A | Plant growth regulant carbamoylphosphonates | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-09-21 | — | — | US | disclosed |
| US-3975464-A | PLANT GROWTH REGULATOR | E. I. DUPONT DE NEMOURS AND COMPANY (US) | 1976-08-17 | — | — | US | disclosed |
| US-3952074-A | PLANT GROWTH REGULATOR | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1976-04-20 | — | — | US | disclosed |