Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.46 |
| ▸ | ATM | Q13315 | 1/20 | 0.46 |
| ▸ | HSD11B1 | P28845 | 2/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.46 |
| ▸ | RHOA | P61586 | 4/20 | 0.45 |
| ▸ | RHOC | P08134 | 3/20 | 0.45 |
| ▸ | TACR1 | P25103 | 8/20 | 0.44 |
| ▸ | SLC18A3 | Q16572 | 1/20 | 0.44 |
| ▸ | TACR2 | P21452 | 2/20 | 0.44 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.43 |
| ▸ | SLC6A9 | P48067 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL6440125 | 1.00 | NPC1 (0.46) | NPC1RAB9AATMHSD11B1KDM4E | |
| SCHEMBL6441184 | 0.91 | RHOA (0.45) | NPC1RAB9AATMHSD11B1RHOA | |
| SCHEMBL5918177 | 0.91 | TACR1 (0.43) | NPC1RAB9AATMHSD11B1RHOA | |
| SCHEMBL6439779 | 0.91 | TACR1 (0.43) | NPC1RAB9AATMHSD11B1RHOA | |
| SCHEMBL5918095 | 0.91 | TACR1 (0.45) | NPC1RAB9AATMHSD11B1KDM4E | |
| SCHEMBL5918094 | 0.91 | TACR1 (0.45) | NPC1RAB9AATMHSD11B1KDM4E | |
| SCHEMBL5918155 | 0.91 | HSD11B1 (0.44) | NPC1RAB9AATMHSD11B1RHOA | |
| SCHEMBL5918148 | 0.91 | TACR1 (0.47) | HSD11B1RHOARHOCTACR1TACR2 | |
| SCHEMBL5802584 | 0.91 | TACR1 (0.47) | HSD11B1RHOARHOCTACR1TACR2 | |
| SCHEMBL5918154 | 0.91 | HSD11B1 (0.44) | NPC1RAB9AATMHSD11B1RHOA |
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-1360184-B1 | PIPERIDINE DERIVATIVES AS NEUROKININ 1 ANTAGONISTS | HOFFMANN LA ROCHE (CH) | 2005-03-30 | — | — | EP | disclosed |
| US-6642226-B2 | Such as cis-(3,5-bis-trifluoromethyl-phenyl)-(4-(4-methyl-piperazin-1-yl),-3-phenyl -piperidin-1-yl)-methanone; for treatment of diseases related to neurokinin receptors | HOFFMAN-LA ROCHE INC. | 2003-11-04 | — | — | US | disclosed |
| US-20020151547-A1 | Substituted phenyl-piperidine methanone compounds | F.HOFFMANN-LA ROCHE AG (CH) | 2002-10-17 | — | — | US | 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-20020151547-A1 | Substituted phenyl-piperidine methanone compounds | TACR1, OPRK1, TACR2 | NPC1 668/4885RAB9A 3009/4885ATM 1608/4885 |
“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.