Known targets — ChEMBL curated mechanism
GABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGRIN1GRIN2AGRIN2BGRIN2CGRIN2DGRIN3AGRIN3BHMGCRMMP1MMP13MMP7MMP8PTGS1PTGS2ileSpolrplArplBrplCrplDrplErplFrplJrplKrplLrplMrplNrplOrplPrplQrplRrplSrplTrplUrplVrplWrplXrplYrpmArpmBrpmCrpmDrpmErpmFrpmGrpmHrpmIrpmJrpsArpsBrpsCrpsDrpsErpsFrpsGrpsHrpsIrpsJrpsKrpsLrpsMrpsNrpsOrpsPrpsQrpsRrpsSrpsTrpsUykgMykgO
The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CCR1 | P32246 | 17/20 | 0.87 |
| ▸ | PTGDR2 | Q9Y5Y4 | 3/20 | 0.56 |
| ▸ | FPR3 | P25089 | 1/20 | 0.51 |
| ▸ | GPR65 | Q8IYL9 | 1/20 | 0.51 |
| ▸ | GPR35 | Q9HC97 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL6466920 | 0.98 | CCR1 (0.87) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL5060676 | 0.93 | CCR1 (1.00) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL6076311 | 0.92 | CCR1 (0.85) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL6465800 | 0.92 | CCR1 (0.98) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL6078527 | 0.90 | CCR1 (0.81) | CCR1PTGDR2FPR3GPR65GPR35 | |
| Ethylenediamine SCHEMBL6463190 | 0.90 | CCR1 (0.93) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL6077571 | 0.89 | CCR1 (0.80) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL4588384 | 0.89 | CCR1 (0.83) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL6254939 | 0.89 | CCR1 (0.83) | CCR1PTGDR2FPR3GPR65GPR35 | |
| SCHEMBL6075709 | 0.89 | CCR1 (0.83) | CCR1PTGDR2FPR3GPR65GPR35 |
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-20050119275-A1 | Salt and crystal forms of (5-chloro-2-{2-[4-(4-fluoro-benzyl)-(2R,5S)-2,5-dimethyl-piperazin-1-yl]-2-oxo-ethoxy}-phenyl)-methanesulfonic acid | PFIZER INC. | 2005-06-02 | — | — | US | disclosed |
| WO-2004113311-A1 | AMORPHOUS UND CRYSTAL FORMS OF (5-CHLORO-2-{2- | PFIZER PRODUCTS INC. (US) | 2004-12-29 | — | — | WO | disclosed |
Patent text — is the patent's own abstract consistent with the prediction?
For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.
| Patent | Title | Text reads most about | Predicted target · text-rank |
|---|---|---|---|
| US-20050119275-A1 | Salt and crystal forms of (5-chloro-2-{2-[4-(4-fluoro-benzyl)-(2R,5S)-2,5-dimethyl-piperazin-1-yl]-2-oxo-ethoxy}-phenyl)-methanesulfonic acid | CCR1, CCR6, CCR3 | CCR1 1/4885PTGDR2 1250/4885FPR3 87/4885 |
“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.