⚠ 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 | |
|---|---|---|---|---|
| Methylsulfanylmethane SCHEMBL5440614 | 0.89 | — | — | |
| Methylsulfanylmethane SCHEMBL27928784 | 0.89 | — | — | |
| Methylsulfanylmethane SCHEMBL1618 | 0.89 | — | — | |
| Methylsulfanylmethane SCHEMBL1330443 | 0.89 | — | — | |
| Methylsulfanylmethane SCHEMBL25351738 | 0.80 | — | — | |
| Methylsulfanylmethane SCHEMBL6940181 | 0.80 | — | — | |
| Methylsulfanylmethane SCHEMBL7706316 | 0.80 | — | — | |
| Methylsulfanylmethane SCHEMBL5139388 | 0.80 | — | — | |
| Methylsulfanylmethane SCHEMBL21037463 | 0.80 | — | — | |
| Methylsulfanylmethane SCHEMBL10814145 | 0.80 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109336794-B | Synthetic method of aryl vinyl trifluoro methyl sulfide compound | 江南大学 | 2020-04-07 | — | — | CN | claimed |
| CN-109336794-B | Synthetic method of aryl vinyl trifluoro methyl sulfide compound | 江南大学 | 2020-04-07 | — | — | CN | disclosed |
| US-6723710-B2 | BORON GROUP-SUBSTITUTED ACYCLIC ALPHA AMINO ACIDS ARE USEFUL FOR INHIBITING A VARIETY OF ARINASE- AND NO SYNTHASE-RELATED DISORDERS, INCLUDING HEART DISEASE, GASTROINTESTINAL MOTILITY DISORDERS, AND PENILE ERECTILE DYSFUNCTION IN HUMANS. | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2004-04-20 | — | — | US | disclosed |
| US-20040063666-A1 | Compositions for inhibiting arginase activity | NATIONAL INSTITUTES OF HEALTH-DIRECTOR DEITR | 2004-04-01 | — | — | US | disclosed |
| US-20030036529-A1 | Compositions and methods for inhibiting arginase activity | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2003-02-20 | — | — | US | disclosed |
| US-6387890-B1 | CARDIOVASCULAR DISORDERS; GASTROINTESTINAL DISORDERS; SEXUAL DISORDERS | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA | 2002-05-14 | — | — | US | disclosed |
| EP-1049660-A1 | COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY | THE TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 2000-11-08 | — | — | EP | disclosed |
| WO-1999019295-A1 | COMPOSITIONS AND METHODS FOR INHIBITING ARGINASE ACTIVITY | TRUSTEES OF THE UNIVERSITY OF PENNSYLVANIA (US) | 1999-04-22 | — | — | WO | disclosed |