⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13819910 | 1.00 | — | — | |
| SCHEMBL13819819 | 1.00 | — | — | |
| SCHEMBL23466099 | 0.86 | SLC22A1 (0.34) | — | |
| SCHEMBL2377577 | 0.84 | CHRM2 (0.35) | — | |
| SCHEMBL22255130 | 0.84 | SLC22A1 (0.40) | — | |
| SCHEMBL14431939 | 0.78 | — | — | |
| SCHEMBL19045071 | 0.78 | — | — | |
| SCHEMBL6625522 | 0.78 | — | — | |
| SCHEMBL10691941 | 0.78 | — | — | |
| SCHEMBL23315960 | 0.78 | OPRM1 (0.31) | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023141866-A1 | PYRAZOLOPYRIMIDINES AS MODULATORS OF SPERMINE OXIDASE | JANSSEN PHARMACEUTICA NV (BE) | 2023-08-03 | — | — | WO | disclosed |
| WO-2020081572-A1 | TRANSCRIPTIONAL ENHANCED ASSOCIATE DOMAIN (TEAD) TRANSCRIPTION FACTOR INHIBITORS AND USES THEREOF | DANA-FARBER CANCER INSTITUTE, INC. (US) | 2020-04-23 | — | — | WO | disclosed |
| US-20160311759-A1 | Lipids and Lipid Compositions for the Delivery of Active Agents | NOVARTIS AG (CH) | 2016-10-27 | — | — | US | disclosed |
| US-8945725-B2 | Organic electroluminescence device | UDC IRELAND LIMITED (IE) | 2015-02-03 | — | — | US | disclosed |
| WO-2012175962-A1 | COMPOUNDS FOR USE IN STABILISING p53 MUTANTS | MEDICAL RESEARCH COUNCIL (GB) | 2012-12-27 | — | — | WO | disclosed |
| US-8278343-B2 | Pyrrolidines | PFIZER INC. (US) | 2012-10-02 | — | — | US | disclosed |
| US-20120153816-A1 | ORGANIC ELECTROLUMINESCENCE DEVICE | FUJIFILM CORPORATION (JP) | 2012-06-21 | — | — | US | disclosed |
| US-20100120793-A1 | Pyrrolidines | PFIZER ANIMAL HEALTH UK 1 LIMITED (GB) | 2010-05-13 | — | — | US | disclosed |
| US-20070191333-A1 | Antibacterial agents | WARNER LAMBERT COMPANY LLC | 2007-08-16 | — | — | US | disclosed |