⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7712386 | 0.96 | — | — | |
| SCHEMBL5318552 | 0.68 | CYP2D6 (0.33) | — | |
| SCHEMBL10388136 | 0.68 | KDM4E (0.34) | — | |
| SCHEMBL9079943 | 0.64 | CYP2D6 (0.37) | — | |
| SCHEMBL6429482 | 0.64 | CYP2D6 (0.37) | — | |
| SCHEMBL1451767 | 0.64 | P2RX7 (0.33) | — | |
| SCHEMBL6908148 | 0.64 | KMT2A (0.34) | — | |
| Fluoride SCHEMBL2469992 | 0.64 | CYP2D6 (0.34) | — | |
| SCHEMBL8732519 | 0.63 | CYP2D6 (0.36) | — | |
| Bicarbonate SCHEMBL7737584 | 0.63 | L3MBTL1 (0.39) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6369181-B1 | COMONOMERS COMPRISING 5-NORBORNENE-2-CARBOXYLIC ACID ESTERS, 5-NORBORNENE-2,3-DICARBOXYLIC ACID MONOMETHYL ESTER, AND MALEIC ANHYDRIDE; ODORLESS; ULTRAVIOLET RAYS OF KRYPTON FLUORIDE OR ARGON FLUORIDE | HYUNDAI ELECTRONICS INDUSTRIES CO., LTD. (KR) | 2002-04-09 | — | — | US | disclosed |