⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL212681 | 0.80 | CHRM5 (0.31) | — | |
| SCHEMBL899312 | 0.76 | CYP2C19 (0.32) | — | |
| SCHEMBL19796057 | 0.74 | HTT (0.46) | — | |
| SCHEMBL51593 | 0.72 | ALDH1A1 (0.41) | — | |
| SCHEMBL8318867 | 0.72 | — | — | |
| SCHEMBL10357806 | 0.71 | LMNA (0.34) | — | |
| SCHEMBL1815350 | 0.69 | TSHR (0.31) | — | |
| SCHEMBL169118 | 0.68 | ALDH1A1 (0.37) | — | |
| SCHEMBL9700923 | 0.68 | POLB (0.39) | — | |
| SCHEMBL15476097 | 0.67 | ALDH1A1 (0.33) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050053862-A1 | Photopolymerizable composition and image recording material | FUJI PHOTO FILM CO., LTD. | 2005-03-10 | — | — | US | disclosed |
| EP-1510865-A2 | Photopolymerizable composition and image recording material | Fuji Photo Film Co., Ltd. (JP) | 2005-03-02 | — | — | EP | disclosed |
| US-5712324-A | 2-HYDROXY-5-ACRYLOYLOXYPHENYL-2H-BENZOTRIAZOLE CROSSLINKING MONOMER | GENERAL ELECTRIC COMPANY (US) | 1998-01-27 | — | — | US | disclosed |
| EP-0736577-A1 | UV-curable weather resistant coatings | GENERAL ELECTRIC COMPANY (US) | 1996-10-09 | — | — | EP | disclosed |
| EP-0599265-A1 | Antibacterial, antifungal compound and its production method | Takeda Chemical Industries, Ltd. (JP) | 1994-06-01 | — | — | EP | disclosed |