Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 4/20 | 0.55 |
| ▸ | PIK3CA | P42336 | 4/20 | 0.55 |
| ▸ | NPC1 | O15118 | 2/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | DRD2 | P14416 | 1/20 | 0.53 |
| ▸ | DRD3 | P35462 | 1/20 | 0.53 |
| ▸ | HTR2C | P28335 | 1/20 | 0.52 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.51 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.51 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.51 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.51 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.50 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.49 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | HPGD | P15428 | 1/20 | 0.49 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.48 |
| ▸ | HDAC7 | Q8WUI4 | 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 | |
|---|---|---|---|---|
| SCHEMBL14005168 | 0.84 | NPC1 (0.50) | EGFRPIK3CANPC1RAB9ADRD2 | |
| SCHEMBL14005159 | 0.78 | IDO1 (0.53) | EGFRPIK3CANPC1RAB9AKDM4E | |
| SCHEMBL22672938 | 0.76 | NPC1 (0.57) | EGFRPIK3CANPC1RAB9AKDM4E | |
| SCHEMBL446419 | 0.73 | KDM4E (0.56) | NPC1RAB9ADRD2DRD3HTR2C | |
| SCHEMBL3246963 | 0.73 | KDM4E (0.68) | NPC1RAB9ADRD2DRD3HTR2C | |
| SCHEMBL24076391 | 0.73 | KDM4E (0.65) | DRD2DRD3HTR2CKDM4EALDH1A1 | |
| SCHEMBL30301403 | 0.73 | KDM4E (0.65) | DRD2DRD3HTR2CKDM4EALDH1A1 | |
| SCHEMBL13753861 | 0.72 | DRD2 (0.84) | DRD2DRD3HTR2CKDM4EALDH1A1 | |
| SCHEMBL13753661 | 0.72 | KDM4E (0.72) | EGFRPIK3CANPC1RAB9ADRD2 | |
| SCHEMBL16627663 | 0.72 | SMYD3 (0.53) | DRD2DRD3HTR2CKDM4EALDH1A1 |
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-8809846-B2 | Organic molecular memories and organic molecules for organic molecular memories | KABUSHIKI KAISHA TOSHIBA (JP) | 2014-08-19 | — | — | US | disclosed |
| US-20080293711-A1 | Chemokine receptor modulators | METASTATIX, INC. | 2008-11-27 | — | — | 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-20080293711-A1 | Chemokine receptor modulators | CCR5, CCL2, CXCR4 | EGFR 351/4885PIK3CA 1094/4885NPC1 363/4885 |
“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.