⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2708067 | 1.00 | — | — | |
| SCHEMBL78830 | 1.00 | — | — | |
| SCHEMBL8513928 | 0.97 | KDM4E (0.33) | — | |
| SCHEMBL16248006 | 0.97 | KDM4E (0.33) | — | |
| Phosphine SCHEMBL28056004 | 0.97 | — | — | |
| Phosphoric Acid SCHEMBL4953743 | 0.84 | KDM4E (0.32) | — | |
| Phosphoric Acid SCHEMBL4948011 | 0.84 | KDM4E (0.32) | — | |
| SCHEMBL10624955 | 0.80 | — | — | |
| SCHEMBL9975648 | 0.78 | — | — | |
| SCHEMBL14583499 | 0.76 | CHRM2 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-117986241-A | Biphenyl derivative, pharmaceutical composition and application thereof | 武汉睿健医药科技有限公司 | 2024-05-07 | — | — | CN | disclosed |
| US-20160058874-A1 | CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY | CERULEAN PHARMA INC. (US) | 2016-03-03 | — | — | US | disclosed |
| US-20150284362-A1 | CARBAZOLE-CONTAINING AMIDES, CARBAMATES, AND UREAS AS CRYPTOCHROME MODULATORS | Synchronicity Pharma, Inc. | 2015-10-08 | — | — | US | disclosed |
| US-20150005230-A1 | CYCLODEXTRIN-BASED POLYMERS FOR THERAPEUTIC DELIVERY | CERULEAN PHARMA INC. (US) | 2015-01-01 | — | — | US | disclosed |
| US-20100112658-A1 | Transformed Saccharomyces cerevisiae Engineered for Xylose Utilization | LIFESENSORS, INC. | 2010-05-06 | — | — | US | disclosed |