⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4966161 | 1.00 | — | — | |
| SCHEMBL604282 | 1.00 | — | — | |
| SCHEMBL10599192 | 0.80 | KDM4E (0.31) | — | |
| SCHEMBL3373064 | 0.80 | — | — | |
| SCHEMBL7261141 | 0.80 | — | — | |
| SCHEMBL601986 | 0.78 | — | — | |
| SCHEMBL3926281 | 0.75 | SLC6A3 (0.36) | — | |
| SCHEMBL19946655 | 0.72 | — | — | |
| SCHEMBL3248367 | 0.72 | ACHE (0.39) | — | |
| SCHEMBL11511270 | 0.71 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101341251-A | Method for the enzymatic production of 5-norbornen-2-carboxylic acid | BASF SE (DE) | 2009-01-07 | — | — | CN | claimed |
| EP-1966381-A2 | METHOD FOR THE ENZYMATIC PRODUCTION OF 5-NORBORNEN-2-CARBOXYLIC ACID | BASF SE (DE) | 2008-09-10 | — | — | EP | claimed |
| WO-2007071578-A2 | METHOD FOR PRODUCING 5-NORBORNEN-2-CARBOXYLIC ACID FROM 5-NORBORNEN-2-CARBONITRILE USING AN ARYLACETONITRILASE | BASF SE (DE) | 2007-06-28 | — | — | WO | claimed |