Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE | P12821 | 4/20 | 0.49 |
| ▸ | MME | P08473 | 2/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
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 | |
|---|---|---|---|---|
| Benzene SCHEMBL7377125 | 0.87 | ACE (0.52) | ACEMME | |
| SCHEMBL10568535 | 0.87 | MME (0.43) | ACEMMENPC1RAB9ASMN1; SMN2 | |
| Benzene SCHEMBL7366164 | 0.86 | ACE (0.51) | ACEMME | |
| Benzene SCHEMBL10567370 | 0.86 | ACE (0.51) | ACEMME | |
| Benzene SCHEMBL10566919 | 0.84 | ACE (0.50) | ACEMME | |
| Benzene SCHEMBL7369670 | 0.83 | ACE (0.49) | ACEMME | |
| Benzene SCHEMBL10568977 | 0.80 | SMN1; SMN2 (0.43) | NPC1RAB9ASMN1; SMN2ALDH1A1CYP2D6 | |
| SCHEMBL7370831 | 0.79 | CYP1A2 (0.52) | ACEMMESMN1; SMN2ALDH1A1CYP2D6 | |
| SCHEMBL14355566 | 0.71 | SMN1; SMN2 (0.47) | NPC1RAB9ASMN1; SMN2ALDH1A1CYP2D6 | |
| SCHEMBL7431589 | 0.71 | SMN1; SMN2 (0.44) | NPC1RAB9ASMN1; SMN2ALDH1A1CYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0280627-B1 | DERIVATIVES OF N-SUBSTITUTED ALPHA-MERCAPTOMETHYL-BENZENE-PROPANAMIDE, PROCESS FOR THEIR PREPARATION, THEIR USE AS MEDICINES AND COMPOSITIONS CONTAINING THEM | ROUSSEL-UCLAF (FR) | 1993-04-21 | — | — | EP | disclosed |
| US-4804616-A | AFTER BLACK AND WHITE DEVELOPMENT, USING A RINSING BATH OF PRESCRIBED PH AND LARGE VOLUME TO ELIMINATE SUBSEQUENT WASHING BATHS | FUJI PHOTO FILM CO., LTD. (JP) | 1989-02-14 | — | — | US | disclosed |
| EP-0280627-A2 | Derivatives of N-substituted alpha-mercaptomethyl-benzene-propanamide, process for their preparation, their use as medicines and compositions containing them | ROUSSEL-UCLAF (FR) | 1988-08-31 | — | — | EP | disclosed |