⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2139195 | 0.86 | — | — | |
| SCHEMBL11767005 | 0.70 | — | — | |
| SCHEMBL57311 | 0.62 | ACHE (0.57) | — | |
| SCHEMBL755198 | 0.59 | — | — | |
| SCHEMBL19337923 | 0.59 | FBP1 (0.33) | — | |
| SCHEMBL25415087 | 0.58 | ACHE (0.50) | — | |
| SCHEMBL9078449 | 0.58 | — | — | |
| SCHEMBL6370184 | 0.57 | DNMT1 (0.38) | — | |
| SCHEMBL14900032 | 0.57 | KMT2A (0.36) | — | |
| SCHEMBL944301 | 0.57 | ACHE (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2014153054-A1 | POLYURETHANES, ARTICLES AND COATINGS PREPARED THEREFROM AND METHODS OF MAKING THE SAME | PPG INDUSTRIES OHIO, INC. (US) | 2014-09-25 | — | — | WO | disclosed |
| EP-2411433-A1 | POLYURETHANES, ARTICLES AND COATINGS PREPARED THEREFROM AND METHODS OF MAKING THE SAME | PPG Industries Ohio, Inc. (US) | 2012-02-01 | — | — | EP | disclosed |
| WO-2010110784-A1 | POLYURETHANES, ARTICLES AND COATINGS PREPARED THEREFROM AND METHODS OF MAKING THE SAME | PPG INDUSTRIES OHIO, INC. (US) | 2010-09-30 | — | — | WO | disclosed |
| US-20050171302-A1 | Coating composition for tendon for prestressed concrete | SHINKO WIRE CO., LTD. (JP) | 2005-08-04 | — | — | US | disclosed |