⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15179655 | 0.75 | — | — | |
| SCHEMBL4957834 | 0.72 | — | — | |
| SCHEMBL125283 | 0.72 | — | — | |
| 2-Bromoethanol SCHEMBL877195 | 0.67 | — | — | |
| SCHEMBL21858846 | 0.67 | — | — | |
| Hydroxyl Radical SCHEMBL435194 | 0.67 | — | — | |
| Ethylene Glycol SCHEMBL2307225 | 0.67 | — | — | |
| SCHEMBL51847 | 0.62 | — | — | |
| Alcohol SCHEMBL660675 | 0.62 | — | — | |
| SCHEMBL17288337 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-103224497-A | Inhibitors of protein kinases | PORTOLA PHARM INC | 2013-07-31 | — | — | CN | disclosed |
| CN-102066339-A | 2, 6-diamino-pyrimidin-5-yl-carboxamides as SYK or JAK protein kinase inhibitors | PORTOLA PHARM INC | 2011-05-18 | — | — | CN | disclosed |
| CN-102066340-A | 2, 6-diamino-pyrimidin- 5-yl-carboxamides as SRK or JAK kinases inhibitors | PORTOLA PHARM INC | 2011-05-18 | — | — | CN | disclosed |
| CN-101516850-A | Heteroaryl compounds useful as inhibitors of E1 activating enzyme | MILLENNIUM PHARM INC (US) | 2009-08-26 | — | — | CN | disclosed |