⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27587419 | 1.00 | — | — | |
| SCHEMBL27515225 | 1.00 | — | — | |
| SCHEMBL27863840 | 0.81 | SLC22A6 (0.35) | — | |
| SCHEMBL27863869 | 0.81 | SLC22A6 (0.35) | — | |
| SCHEMBL9447277 | 0.81 | — | — | |
| SCHEMBL4112703 | 0.77 | — | — | |
| SCHEMBL27667955 | 0.77 | — | — | |
| SCHEMBL27807158 | 0.77 | GABRR1 (0.41) | — | |
| SCHEMBL27701682 | 0.77 | — | — | |
| SCHEMBL27613857 | 0.77 | — | — |
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 11 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101253167-A | Substituted imidazole compounds as KSP inhibitors | NOVARTIS VACCINES & DIAGNOSTIC (CH) | 2008-08-27 | — | — | CN | claimed |
| CN-1512983-A | Compounds and compositions as cathepsins inhibitors | AXYSҩ�﹫˾ | 2004-07-14 | — | — | CN | claimed |
| CN-102711476-B | Novel tricyclic compounds | ABBVIE LAB | 2014-12-03 | — | — | CN | disclosed |
| CN-101018780-B | Pyrazole-substituted aminoheteroaryl compounds as protein kinase inhibitors | PFIZER | 2012-01-11 | — | — | CN | disclosed |
| CN-100548996-C | 5-phenylthiazole derivatives and their use for the preparation of medicaments | NOVARTIS AG (CH) | 2009-10-14 | — | — | CN | disclosed |
| CN-100439344-C | 4-Anilinoquinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (SE) | 2008-12-03 | — | — | CN | disclosed |
| CN-101018780-A | Pyrazole-substituted aminoheteroaryl compounds as protein kinase inhibitors | AGOURON PHARMA (US) | 2007-08-15 | — | — | CN | disclosed |
| CN-101003515-A | 4-anilino quinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (SE) | 2007-07-25 | — | — | CN | disclosed |
| CN-1656081-A | 4-Anilinoquinazoline derivatives as antiproliferative agents | ASTRAZENECA AB (SE) | 2005-08-17 | — | — | CN | disclosed |
| CN-1639139-A | 5-phenylthiazole derivatives and use as PI3 kinase inhibitors | NOVARTIS AG (CH) | 2005-07-13 | — | — | CN | disclosed |
| CN-1512983-A | Compounds and compositions as cathepsins inhibitors | AXYSҩ�﹫˾ | 2004-07-14 | — | — | CN | disclosed |