Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR1 | P21554 | 2/20 | 0.70 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.64 |
| ▸ | POLB | P06746 | 2/20 | 0.60 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.60 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.60 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.60 |
| ▸ | CA1 | P00915 | 1/20 | 0.58 |
| ▸ | CA2 | P00918 | 1/20 | 0.58 |
| ▸ | ACHE | P22303 | 1/20 | 0.58 |
| ▸ | MMP2 | P08253 | 2/20 | 0.57 |
| ▸ | CA12 | O43570 | 1/20 | 0.57 |
| ▸ | CA9 | Q16790 | 1/20 | 0.57 |
| ▸ | CA14 | Q9ULX7 | 1/20 | 0.57 |
| ▸ | LOXL2 | Q9Y4K0 | 3/20 | 0.56 |
| ▸ | AOC3 | Q16853 | 2/20 | 0.56 |
| ▸ | MMP9 | P14780 | 2/20 | 0.55 |
| ▸ | MMP1 | P03956 | 1/20 | 0.55 |
| ▸ | MMP3 | P08254 | 1/20 | 0.55 |
| ▸ | MMP7 | P09237 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL29259797 | 0.92 | CA1 (0.68) | CNR1ALDH1A1POLBCA1CA2 | |
| SCHEMBL28354122 | 0.86 | CNR1 (0.77) | CNR1ALDH1A1CA1CA2ACHE | |
| SCHEMBL25193424 | 0.85 | CNR1 (0.60) | CNR1CA1CA2ACHEMMP2 | |
| SCHEMBL25264635 | 0.85 | CNR1 (0.60) | CNR1CA1CA2ACHEMMP2 | |
| SCHEMBL29259795 | 0.85 | CNR1 (0.60) | CNR1ALDH1A1CA1CA2ACHE | |
| SCHEMBL25181527 | 0.85 | CA1 (0.63) | CNR1CA1CA2ACHEMMP2 | |
| SCHEMBL25181528 | 0.85 | CA1 (0.63) | CNR1CA1CA2ACHEMMP2 | |
| SCHEMBL29259802 | 0.85 | CNR1 (0.60) | CNR1ALDH1A1CA1CA2ACHE | |
| SCHEMBL29259799 | 0.85 | CNR1 (0.60) | CNR1ALDH1A1POLBCA1CA2 | |
| SCHEMBL28426090 | 0.85 | ALDH1A1 (0.73) | CNR1ALDH1A1POLBCYP2C19CA2 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024164666-A1 | METHOD FOR PREPARING BENZYLAMINE DERIVATIVE BY VISIBLE LIGHT-PROMOTED NICKEL-CATALYZED AMINATION OF BENZYL C-H BONDS | 上海沃凯生物技术有限公司 | 2024-08-15 | — | — | WO | disclosed |
| CN-116063209-B | Method for preparing benzylamine derivative by catalyzing amination of benzyl C-H bond through nickel under promotion of visible light | 上海沃凯生物技术有限公司 | 2024-04-09 | — | — | CN | disclosed |
| CN-116063209-A | Method for preparing benzylamine derivative by catalyzing amination of benzyl C-H bond through nickel under promotion of visible light | 上海沃凯生物技术有限公司 | 2023-05-05 | — | — | CN | disclosed |
| US-4468245-A | N-(2,3-Epoxypropylene)-n-aralkylsulfonamide and herbicidal compositions containing the same | MITSUBISHI CHEMICAL INDUSTRIES LTD. (JP) | 1984-08-28 | — | — | US | disclosed |