⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL28459730 | 0.96 | — | — | |
| SCHEMBL403101 | 0.96 | — | — | |
| SCHEMBL21352 | 0.96 | — | — | |
| Hydrochloric Acid SCHEMBL28439915 | 0.92 | — | — | |
| Water SCHEMBL28328303 | 0.92 | — | — | |
| Ethylene SCHEMBL21772405 | 0.89 | — | — | |
| SCHEMBL10753300 | 0.86 | KMT2A (0.33) | — | |
| SCHEMBL20718942 | 0.86 | TSHR (0.40) | — | |
| SCHEMBL10753305 | 0.86 | KMT2A (0.33) | — | |
| Bicarbonate SCHEMBL9752391 | 0.83 | KDM4E (0.41) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5104966-A | Polyimide film of aromatic tetracarboxylic acid, aromatic diamine and aliphatic diamine; heat resistance, durability | E. I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-04-14 | — | — | US | disclosed |
| US-4271288-A | TETRACARBOXYLIC ACID BONDED TO ARYLENE MOIETY VIA METHYLENE GROUPS | THE DOW CHEMICAL COMPANY (US) | 1981-06-02 | — | — | US | disclosed |