Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | OPRL1 | P41146 | 10/20 | 0.60 |
| ▸ | OPRM1 | P35372 | 8/20 | 0.60 |
| ▸ | OPRK1 | P41145 | 3/20 | 0.60 |
| ▸ | OPRD1 | P41143 | 3/20 | 0.57 |
| ▸ | TRPV6 | Q9H1D0 | 1/20 | 0.54 |
| ▸ | TRPV5 | Q9NQA5 | 1/20 | 0.54 |
| ▸ | CHRM4 | P08173 | 1/20 | 0.49 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.49 |
| ▸ | TP53 | P04637 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | PKM | P14618 | 1/20 | 0.49 |
| ▸ | TSHR | P16473 | 1/20 | 0.49 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.49 |
| ▸ | THPO | P40225 | 1/20 | 0.49 |
| ▸ | MTOR | P42345 | 1/20 | 0.49 |
| ▸ | EBP | Q15125 | 1/20 | 0.49 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL3772583 | 0.98 | OPRL1 (0.58) | OPRL1OPRM1OPRK1OPRD1TRPV6 | |
| SCHEMBL13005268 | 0.87 | HTT (0.49) | OPRL1OPRM1OPRK1OPRD1KDM4E | |
| SCHEMBL13005270 | 0.85 | ALDH1A1 (0.48) | OPRL1OPRM1OPRK1OPRD1KDM4E | |
| SCHEMBL3774342 | 0.85 | NPSR1 (0.46) | OPRL1OPRM1OPRK1OPRD1CYP2D6 | |
| SCHEMBL3772438 | 0.83 | NPSR1 (0.44) | OPRL1OPRM1OPRK1OPRD1CYP2D6 | |
| SCHEMBL3773978 | 0.81 | POLB (0.60) | SMN1; SMN2MEN1KMT2A | |
| SCHEMBL3777229 | 0.80 | KMT2A (0.60) | OPRL1OPRM1OPRK1OPRD1TSHR | |
| SCHEMBL3769985 | 0.80 | POLB (0.59) | SMN1; SMN2MEN1KMT2A | |
| SCHEMBL3127147 | 0.79 | MAPT (0.54) | OPRL1OPRM1OPRK1CHRM4ABCB11 | |
| SCHEMBL3772549 | 0.79 | MEN1 (0.64) | CYP3A4CYP2D6SIGMAR1KDM4EMEN1 |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7851474-B2 | Dipiperazinyl ketones and related analogues | NEUROGEN CORPORATION (US) | 2010-12-14 | — | — | US | disclosed |
| US-7851474-B2 | Dipiperazinyl ketones and related analogues | NEUROGEN CORPORATION (US) | 2010-12-14 | — | — | US | disclosed |
| US-20070049571-A1 | Dipiperazinyl ketones and related analogues | NEUROGEN CORPORATION | 2007-03-01 | — | — | US | disclosed |
| US-20070049571-A1 | Dipiperazinyl ketones and related analogues | NEUROGEN CORPORATION | 2007-03-01 | — | — | US | disclosed |
| WO-2007016496-A2 | DIPIPERAZINYL KETONES AND RELATED ANALOGUES | NEUROGEN CORPORATION (US) | 2007-02-08 | — | — | 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-20070049571-A1 | Dipiperazinyl ketones and related analogues | HRH4, HRH3, HRH1 | OPRL1 347/4885OPRM1 743/4885OPRK1 287/4885 |
“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.