Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.56 |
| ▸ | APP | P05067 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.51 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.51 |
| ▸ | MAPT | P10636 | 4/20 | 0.51 |
| ▸ | LMNA | P02545 | 4/20 | 0.51 |
| ▸ | PLEC | Q15149 | 1/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.50 |
| ▸ | MEN1 | O00255 | 3/20 | 0.50 |
| ▸ | SNCA | P37840 | 1/20 | 0.44 |
| ▸ | POLB | P06746 | 1/20 | 0.43 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.43 |
| ▸ | GRIN2D | O15399 | 2/20 | 0.42 |
| ▸ | GRIN3B | O60391 | 2/20 | 0.42 |
| ▸ | GRIN1 | Q05586 | 2/20 | 0.42 |
| ▸ | GRIN2A | Q12879 | 2/20 | 0.42 |
| ▸ | GRIN2B | Q13224 | 2/20 | 0.42 |
| ▸ | GRIN2C | Q14957 | 2/20 | 0.42 |
| ▸ | GRIN3A | Q8TCU5 | 2/20 | 0.42 |
| ▸ | PIP4K2A | P48426 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL29981581 | 1.00 | TRPA1 (0.56) | TRPA1APPKDM4EALDH1A1MAPT | |
| Dimethylamine SCHEMBL6748737 | 0.93 | KMT2A (0.53) | TRPA1APPKDM4EALDH1A1MAPT | |
| SCHEMBL9848553 | 0.84 | TRPA1 (0.51) | TRPA1APPKDM4EALDH1A1MAPT | |
| SCHEMBL13938652 | 0.81 | KDM4E (0.48) | KDM4EALDH1A1MAPTLMNAPLEC | |
| SCHEMBL9735148 | 0.79 | ALDH1A1 (0.50) | APPKDM4EALDH1A1MAPTLMNA | |
| SCHEMBL29164994 | 0.79 | PIP4K2A (0.53) | KDM4EALDH1A1MAPTKMT2AMEN1 | |
| SCHEMBL9735153 | 0.79 | ALDH1A1 (0.50) | APPKDM4EALDH1A1MAPTLMNA | |
| SCHEMBL4661306 | 0.78 | CRHBP (0.60) | KDM4EALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL4661300 | 0.78 | CRHBP (0.60) | KDM4EALDH1A1MAPTLMNAKMT2A | |
| SCHEMBL11855887 | 0.78 | CRHBP (0.41) | KDM4EALDH1A1MAPTLMNAKMT2A |
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 12 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-118287150-A | Method for efficiently catalyzing Knoevenagel condensation reaction by porphyrin and quaternary ammonium salt synergistic catalytic system | 沈阳药科大学 | 2024-07-05 | — | — | CN | disclosed |
| CN-113135856-B | 3-trifluoromethyl-5-cyanopyrazole compounds and preparation method thereof | 天津大学 | 2022-10-11 | — | — | CN | disclosed |
| CN-113135856-A | 3-trifluoromethyl-5-cyanopyrazole compounds and preparation method thereof | 天津大学 | 2021-07-20 | — | — | CN | disclosed |
| US-20180141911-A1 | Quinoline Derivatives for Diagnosis and Treatment of Alzheimer's Disease | NORTHEASTERN UNIVERSITY | 2018-05-24 | — | — | US | disclosed |
| WO-2016183578-A1 | QUINOLINE DERIVATIVES FOR DIAGNOSIS AND TREATMENT OF ALZHEIMER'S DISEASE | NORTHEASTERN UNIVERSITY (US) | 2016-11-17 | — | — | WO | disclosed |
| CN-103804268-B | A kind of method efficiently synthesizing the functionalization enamine with high regioselectivity | 陕西师范大学 | 2016-06-29 | — | — | CN | disclosed |
| CN-103804268-A | Method for efficiently synthesizing functional enamine with high regioselectivity | UNIV SHAANXI NORMAL | 2014-05-21 | — | — | CN | disclosed |
| US-7425580-B2 | (Diaryl-methyl)-malononitriles and their use as estrogen receptor ligands | WYETH (US) | 2008-09-16 | — | — | US | disclosed |
| EP-1747192-A1 | (DIARYL-METHYL)-MALONONITRILES AND THEIR USE AS ESTROGEN RECEPTOR LIGANDS | Wyeth (US) | 2007-01-31 | — | — | EP | disclosed |
| US-20060014831-A1 | (Diaryl-methyl)-malononitriles and their use as estrogen receptor ligands | WYETH (US) | 2006-01-19 | — | — | US | disclosed |
| WO-2005121076-A1 | (DIARYL-METHYL)-MALONONITRILES AND THEIR USE AS ESTROGEN RECEPTOR LIGANDS | WYETH (US) | 2005-12-22 | — | — | WO | disclosed |
| US-4184871-A | A,B-UNSATURATED NITRILE SENSITIZER | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1980-01-22 | — | — | 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 (2 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-20060014831-A1 | (Diaryl-methyl)-malononitriles and their use as estrogen receptor ligands | ESR1, ESR2, GPER1 | TRPA1 1039/4885APP 4289/4885KDM4E 286/4885 |
| US-20180141911-A1 | Quinoline Derivatives for Diagnosis and Treatment of Alzheimer's Disease | MAPT, PSEN1, PSEN2 | TRPA1 3875/4885APP 4/4885KDM4E 3865/4885 |
“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.