⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27746130 | 0.92 | TSHR (0.35) | — | |
| SCHEMBL15923449 | 0.90 | LMNA (0.36) | — | |
| SCHEMBL3173662 | 0.90 | LMNA (0.36) | — | |
| SCHEMBL6523251 | 0.89 | ALDH1A1 (0.33) | — | |
| SCHEMBL7193256 | 0.84 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL31368881 | 0.83 | — | — | |
| SCHEMBL997152 | 0.83 | — | — | |
| SCHEMBL20889082 | 0.83 | — | — | |
| SCHEMBL19257464 | 0.83 | TSHR (0.41) | — | |
| SCHEMBL27782220 | 0.83 | TSHR (0.41) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2370442-A1 | 3-AMINOCYCLOPENTANECARBOXAMIDES AS CHEMOKINE RECEPTOR MODULATORS | Pfizer Inc. (US) | 2011-10-05 | — | — | EP | claimed |
| WO-2010061329-A1 | 3-AMINOCYCLOPENTANECARBOXAMIDES AS CHEMOKINE RECEPTOR MODULATORS | PFIZER INC. (US) | 2010-06-03 | — | — | WO | claimed |
| EP-2370442-A1 | 3-AMINOCYCLOPENTANECARBOXAMIDES AS CHEMOKINE RECEPTOR MODULATORS | Pfizer Inc. (US) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010061329-A1 | 3-AMINOCYCLOPENTANECARBOXAMIDES AS CHEMOKINE RECEPTOR MODULATORS | PFIZER INC. (US) | 2010-06-03 | — | — | WO | disclosed |