Known targets — ChEMBL curated mechanism
CACNA1CCACNA1DCACNA1FCACNA1SDPP4HTR1BHTR1D
The experimentally established mechanism targets of Benzoic Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TMEM97 | Q5BJF2 | 2/20 | 0.65 |
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.65 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.61 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.58 |
| ▸ | SLC6A4 | P31645 | 1/20 | 0.58 |
| ▸ | CCR3 | P51677 | 4/20 | 0.58 |
| ▸ | MAOB | P27338 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7295872 | 0.86 | TMEM97 (0.69) | TMEM97SIGMAR1HRH3MEN1KMT2A | |
| SCHEMBL7532119 | 0.84 | TMEM97 (0.63) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| Benzoic Acid SCHEMBL7306730 | 0.83 | CCR3 (0.58) | SLC6A2SLC6A4CCR3 | |
| Hydrochloric Acid SCHEMBL7406276 | 0.82 | TMEM97 (0.80) | TMEM97SIGMAR1HRH3MEN1KMT2A | |
| SCHEMBL7400101 | 0.81 | TMEM97 (0.70) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| SCHEMBL8805916 | 0.81 | SLC6A2 (0.83) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| Hydrochloric Acid SCHEMBL7406556 | 0.80 | TMEM97 (0.68) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 | |
| SCHEMBL7405268 | 0.80 | TMEM97 (0.73) | TMEM97SIGMAR1HRH3MEN1KMT2A | |
| SCHEMBL5888823 | 0.80 | SIGMAR1 (1.00) | TMEM97SIGMAR1HRH3MEN1KMT2A | |
| SCHEMBL8814613 | 0.79 | HRH3 (0.66) | TMEM97SIGMAR1HRH3SLC6A2SLC6A4 |
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 |
|---|---|---|---|---|---|---|---|
| US-5395841-A | 4-benzylpiperidines for treating phychosis | FERRER INTERNACIONAL, S.A. (ES) | 1995-03-07 | — | — | US | claimed |
| US-5395841-A | 4-benzylpiperidines for treating phychosis | FERRER INTERNACIONAL, S.A. (ES) | 1995-03-07 | — | — | US | disclosed |
| EP-0572952-A1 | 4-Benzylpiperidine derivatives, a process for preparing them and pharmaceutical compositions containing them | FERRER INTERNACIONAL, S.A. (ES) | 1993-12-08 | — | — | EP | disclosed |