⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20150358 | 0.94 | HCRTR1 (0.30) | — | |
| SCHEMBL20156215 | 0.91 | ELANE (0.31) | — | |
| SCHEMBL20150356 | 0.90 | SYK (0.33) | — | |
| SCHEMBL20150360 | 0.90 | SYK (0.33) | — | |
| SCHEMBL20150357 | 0.88 | PTGER4 (0.33) | — | |
| SCHEMBL20155940 | 0.86 | RXRA (0.34) | — | |
| SCHEMBL20156274 | 0.86 | RXRA (0.34) | — | |
| SCHEMBL20848708 | 0.85 | ALOX5AP (0.34) | — | |
| SCHEMBL20849540 | 0.84 | KIF11 (0.34) | — | |
| SCHEMBL20848976 | 0.84 | CYP2C9 (0.33) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10421746-B2 | Organic molecules, especially for use in organic optoelectronic devices | CYNORA GMBH (DE) | 2019-09-24 | — | — | US | disclosed |
| US-20180134686-A1 | ORGANIC MOLECULES, ESPECIALLY FOR USE IN ORGANIC OPTOELECTRONIC DEVICES | CYNORA GMBH (DE) | 2018-05-17 | — | — | US | disclosed |