⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16814737 | 0.82 | — | — | |
| SCHEMBL19591091 | 0.79 | SMPD1 (0.44) | — | |
| SCHEMBL19368290 | 0.78 | — | — | |
| SCHEMBL24754053 | 0.76 | SMPD1 (0.53) | — | |
| SCHEMBL2680263 | 0.73 | — | — | |
| SCHEMBL764212 | 0.73 | — | — | |
| SCHEMBL15509215 | 0.73 | — | — | |
| SCHEMBL13872397 | 0.71 | CYP19A1 (0.42) | — | |
| SCHEMBL21524613 | 0.71 | — | — | |
| SCHEMBL9285404 | 0.71 | — | — |
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-10329352-B2 | Pyrrolobenzodiazepines and targeted conjugates | SEATTLE GENETICS, INC. (US) | 2019-06-25 | — | — | US | disclosed |
| WO-2019048881-A1 | OLIGONUCLEOTIDES COMPRISING TRIAZOLE AND (PHOSPHOR)AMIDATE INTERNUCLEOSIDE LINKAGES, METHOD FOR THE PREPARATION AND USES THEREOF | OXFORD UNIVERSITY INNOVATION LIMITED (GB) | 2019-03-14 | — | — | WO | disclosed |
| US-20180092986-A1 | SITE-SPECIFIC ANTIBODY-DRUG CONJUGATES | MEDIMMUNE LIMITED (GB) | 2018-04-05 | — | — | US | disclosed |
| EP-3134520-B1 | PROCESS FOR THE MODIFICATION OF A GLYCOPROTEIN USING A GLYCOSYLTRANSFERASE THAT IS OR IS DERIVED FROM A (1,4)-N-ACETYLGALACTOSAMINYLTRANSFERASE | SYNAFFIX BV (NL) | 2017-12-20 | — | — | EP | disclosed |
| US-20170298137-A1 | PYRROLOBENZODIAZEPINES AND TARGETED CONJUGATES | SEAGEN INC. | 2017-10-19 | — | — | US | disclosed |