⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1668811 | 1.00 | — | — | |
| SCHEMBL1669127 | 1.00 | — | — | |
| SCHEMBL27458159 | 0.76 | — | — | |
| SCHEMBL3391549 | 0.74 | — | — | |
| SCHEMBL14431369 | 0.74 | — | — | |
| SCHEMBL1291200 | 0.70 | — | — | |
| SCHEMBL23002194 | 0.69 | IDUA (0.32) | — | |
| SCHEMBL3412783 | 0.67 | — | — | |
| SCHEMBL19995426 | 0.67 | — | — | |
| SCHEMBL15927307 | 0.67 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9771345-B2 | Coferons and methods of making and using them | CORNELL UNIVERSITY (US) | 2017-09-26 | — | — | US | disclosed |
| US-20120295874-A1 | COFERONS AND METHODS OF MAKING AND USING THEM | CORNELL UNIVERSITY (US) | 2012-11-22 | — | — | US | disclosed |
| WO-2011043817-A1 | COFERONS AND METHODS OF MAKING AND USING THEM | CORNELL UNIVERSITY (US) | 2011-04-14 | — | — | WO | disclosed |
| CN-100343253-C | Tetrahydro-4h-pyrido[1,2-a]pyrimidines and related compounds useful as HIV integrase inhibitors | ANGELETTI P IST RICHERCHE BIO (IT) | 2007-10-17 | — | — | CN | disclosed |
| CN-1753892-A | Tetrahydro-4h-pyrido[1,2-a]pyrimidines and related compounds useful as HIV integrase inhibitors | ANGELETTI P IST RICHERCHE BIO (IT) | 2006-03-29 | — | — | CN | disclosed |
| US-5489693-A | ANTICOAGULANTS | DR. KARK THOMAE, GMBH (DE) | 1996-02-06 | — | — | US | disclosed |