⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29719536 | 0.78 | — | — | |
| SCHEMBL28681176 | 0.74 | — | — | |
| SCHEMBL15432816 | 0.73 | — | — | |
| SCHEMBL28346834 | 0.73 | — | — | |
| SCHEMBL8220006 | 0.71 | ALDH1A1 (0.40) | — | |
| SCHEMBL7622333 | 0.67 | ALDH1A1 (0.42) | — | |
| SCHEMBL1087685 | 0.65 | — | — | |
| SCHEMBL1724327 | 0.65 | — | — | |
| SCHEMBL11108551 | 0.63 | ALDH3A1 (0.42) | — | |
| Methane SCHEMBL28175090 | 0.62 | — | — |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0317912-B1 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF AG (DE) | 1994-02-02 | — | — | EP | claimed |
| EP-0317912-A2 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF Aktiengesellschaft (DE) | 1989-05-31 | — | — | EP | claimed |
| EP-0317912-B1 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF AG (DE) | 1994-02-02 | — | — | EP | disclosed |
| EP-0317912-B1 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF AG (DE) | 1994-02-02 | — | — | EP | disclosed |
| EP-0317912-A3 | PROCESS FOR THE PREPARATION OF 1-THIOCYANATOMETHYL ETHERS | BASF Aktiengesellschaft (DE) | 1991-02-06 | — | — | EP | disclosed |
| EP-0317912-A3 | PROCESS FOR THE PREPARATION OF 1-THIOCYANATOMETHYL ETHERS | BASF Aktiengesellschaft (DE) | 1991-02-06 | — | — | EP | disclosed |
| EP-0317912-A2 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF Aktiengesellschaft (DE) | 1989-05-31 | — | — | EP | disclosed |
| EP-0317912-A2 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF Aktiengesellschaft (DE) | 1989-05-31 | — | — | EP | disclosed |
| EP-0317912-A2 | Process for the preparation of 1-thiocyanatomethyl ethers | BASF Aktiengesellschaft (DE) | 1989-05-31 | — | — | EP | disclosed |
| US-4131730-A | Modified polyamic acid from aminophthalic acid anhydride and dianhydride | ALELIO GAETANO F D | 1978-12-26 | — | — | US | disclosed |
| US-4064113-A | POLYAMIC ACID | ALELIO GAETANO F D | 1977-12-20 | — | — | US | disclosed |
| US-3979416-A | REFRIGERATED WATER, PRECIPITATION | ALELIO GAETANO F D | 1976-09-07 | — | — | US | disclosed |