Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.35 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.33 |
| ▸ | MAPT | P10636 | 1/20 | 0.33 |
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | RAB9A | P51151 | 1/20 | 0.33 |
| ▸ | ANPEP | P15144 | 1/20 | 0.32 |
| ▸ | ERAP2 | Q6P179 | 1/20 | 0.32 |
| ▸ | POLB | P06746 | 1/20 | 0.32 |
| ▸ | LMNA | P02545 | 2/20 | 0.32 |
| ▸ | SIGMAR1 | Q99720 | 3/20 | 0.31 |
| ▸ | CXCR4 | P61073 | 2/20 | 0.31 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.30 |
| ▸ | KCNJ1 | P48048 | 1/20 | 0.30 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| Tert-Butyl Formate SCHEMBL27998227 | 0.83 | TDP1 (0.43) | TDP1ALDH1A1KDM4EMEN1KMT2A | |
| Tert-Butyl Formate SCHEMBL27600872 | 0.81 | TDP1 (0.42) | TDP1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL27718748 | 0.81 | TDP1 (0.42) | TDP1ALDH1A1KDM4EMEN1KMT2A | |
| Tert-Butyl Formate SCHEMBL28313688 | 0.81 | TDP1 (0.42) | TDP1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL27997975 | 0.81 | TDP1 (0.42) | TDP1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL28025116 | 0.81 | TDP1 (0.42) | TDP1ALDH1A1KDM4EMEN1KMT2A | |
| Tert-Butyl Formate SCHEMBL27721169 | 0.81 | TDP1 (0.42) | TDP1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL27844340 | 0.80 | HRH2 (0.42) | TDP1ALDH1A1MEN1KMT2ASMN1; SMN2 | |
| Tert-Butyl Formate SCHEMBL28088768 | 0.80 | TDP1 (0.41) | TDP1ALDH1A1KDM4EMEN1KMT2A | |
| SCHEMBL17284646 | 0.80 | POLB (0.45) | ALDH1A1KDM4EMEN1KMT2ASMN1; SMN2 |
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 |
|---|---|---|---|---|---|---|---|
| CN-109970743-A | 5-chloro-2-difluoromethoxyphenyl pyrazolopyrimidine compounds as JAK inhibitors | 豪夫迈·罗氏有限公司 | 2019-07-05 | — | — | CN | disclosed |
| CN-106459039-A | 5-chloro-2-difluoromethoxyphenyl pyrazolopyrimidine compounds as JAK inhibitors | 豪夫迈·罗氏有限公司 | 2017-02-22 | — | — | CN | disclosed |