Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.40 |
| ▸ | TGFBR1 | P36897 | 1/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.36 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 2/20 | 0.36 |
| ▸ | CA9 | Q16790 | 2/20 | 0.36 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.36 |
| ▸ | MAOB | P27338 | 2/20 | 0.36 |
| ▸ | MGLL | Q99685 | 1/20 | 0.35 |
| ▸ | P2RX3 | P56373 | 1/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 4/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | RAB9A | P51151 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.34 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.33 |
| ▸ | ESR1 | P03372 | 1/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.33 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL28659778 | 1.00 | SMN1; SMN2 (0.40) | SMN1; SMN2TGFBR1CA12CA1CA2 | |
| SCHEMBL28661046 | 0.93 | SMN1; SMN2 (0.40) | SMN1; SMN2TGFBR1MAOBMGLLHDAC1 | |
| SCHEMBL22516881 | 0.86 | TGFBR1 (0.37) | SMN1; SMN2TGFBR1MAOBMGLLP2RX3 | |
| SCHEMBL22517027 | 0.86 | HDAC1 (0.36) | SMN1; SMN2TGFBR1CA12CA1CA2 | |
| SCHEMBL22501104 | 0.86 | MEN1 (0.41) | SMN1; SMN2P2RX3HDAC1ALDH1A1RAB9A | |
| SCHEMBL28676990 | 0.86 | MEN1 (0.41) | SMN1; SMN2P2RX3HDAC1ALDH1A1RAB9A | |
| SCHEMBL24437233 | 0.85 | ALDH1A1 (0.46) | SMN1; SMN2TGFBR1P2RX3HDAC1ALDH1A1 | |
| SCHEMBL22500068 | 0.85 | ALDH1A1 (0.46) | SMN1; SMN2TGFBR1P2RX3HDAC1ALDH1A1 | |
| SCHEMBL28655361 | 0.85 | ALDH1A1 (0.46) | SMN1; SMN2TGFBR1P2RX3HDAC1ALDH1A1 | |
| SCHEMBL24437147 | 0.84 | HDAC1 (0.40) | TGFBR1CA12CA1CA2CA7 |
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-113660932-B | Phenyl derivatives having pendant alkyl and alkenyl extensions and pharmaceutical compositions comprising the same | 景凯生物科技股份有限公司 | 2024-07-12 | — | — | CN | disclosed |
| CN-113660932-A | Phenyl derivatives with pendant alkyl and alkenyl extensions and pharmaceutical compositions comprising the same | 景凯生物科技股份有限公司 | 2021-11-16 | — | — | CN | disclosed |