⚠ 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 | |
|---|---|---|---|---|
| Carbamic Acid SCHEMBL17351904 | 0.95 | — | — | |
| Carbamic Acid SCHEMBL6545635 | 0.90 | — | — | |
| Carbamic Acid SCHEMBL28208928 | 0.90 | — | — | |
| SCHEMBL11842695 | 0.90 | — | — | |
| Carbamic Acid SCHEMBL27811102 | 0.86 | — | — | |
| Carbamic Acid SCHEMBL2564971 | 0.84 | ACHE (1.00) | — | |
| Carbamic Acid SCHEMBL4456232 | 0.84 | ACHE (1.00) | — | |
| Carbamic Acid SCHEMBL5048206 | 0.84 | ACHE (1.00) | — | |
| SCHEMBL78716 | 0.84 | CA1 (0.50) | — | |
| Carbamic Acid SCHEMBL75781 | 0.84 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2155710-A2 | PROCESS FOR THE PREPARATION OF ESCITALOPRAM VIA DESMETHYLCITALOPRAM, OPTICAL RESOLUTION AND METHYLATION OF THE S-ISOMER | Cipla Limited (IN) | 2010-02-24 | — | — | EP | claimed |
| WO-2008142379-A2 | PROCESS FOR THE PREPARATION OF ESCITALOPRAM VIA DESMETHYLCITALOPRAM, OPTICAL RESOLUTION AND METHYLATION OF THE S-ISOMER | CIPLA LIMITED (IN) | 2008-11-27 | — | — | WO | claimed |
| CN-107646031-A | Novel azetidine derivatives as modulators of cortical catecholaminergic neurotransmission | 综合研究实验室瑞典股份公司 | 2018-01-30 | — | — | CN | disclosed |
| US-4059615-A | INSECTICIDE, POLYMER INTERMEDIATE | HOOKER CHEMICALS & PLASTICS CORPORATION (US) | 1977-11-22 | — | — | US | disclosed |