⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27615584 | 0.72 | KDM4E (0.39) | — | |
| SCHEMBL3281875 | 0.67 | PARG (0.50) | — | |
| SCHEMBL10668768 | 0.54 | ATM (0.42) | — | |
| SCHEMBL11510681 | 0.54 | MMP2 (0.41) | — | |
| SCHEMBL14896280 | 0.54 | OXER1 (0.40) | — | |
| SCHEMBL15233501 | 0.52 | P2RY2 (0.39) | — | |
| SCHEMBL28512873 | 0.51 | MTNR1A (0.46) | — | |
| SCHEMBL7698123 | 0.51 | LMNA (0.42) | — | |
| SCHEMBL10665742 | 0.51 | NPSR1 (0.52) | — | |
| SCHEMBL28227954 | 0.50 | POLB (0.45) | — |
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-100564358-C | The method of a kind of preparation 4-(3, the 4-dichlorophenoxy) piperidines | ASTRAZENECA AB (SE) | 2009-12-02 | — | — | CN | disclosed |
| CN-100352807-C | substituted piperidine compounds | ASTRAZENECA AB (SE) | 2007-12-05 | — | — | CN | disclosed |
| CN-1907968-A | Method for making 4-(3,4-dichlorophenoxy)piperidine | ASTRAZENECA AB (SE) | 2007-02-07 | — | — | CN | disclosed |
| CN-1633414-A | Compound (I) | ASTRAZENECA AB (SE) | 2005-06-29 | — | — | CN | disclosed |