Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | RAB9A | P51151 | 5/20 | 0.51 |
| ▸ | NPC1 | O15118 | 4/20 | 0.51 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.51 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 1/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.48 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.47 |
| ▸ | FAAH | O00519 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.47 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.47 |
| ▸ | HPGD | P15428 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL28495982 | 0.84 | HTT (0.60) | SMN1; SMN2RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL25987647 | 0.82 | SMN1; SMN2 (0.74) | SMN1; SMN2RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL28488783 | 0.81 | RAB9A (0.36) | SMN1; SMN2RAB9ANPC1KMT2ALMNA | |
| SCHEMBL28496879 | 0.81 | NPC1 (0.65) | SMN1; SMN2RAB9ANPC1LMNACYP3A4 | |
| SCHEMBL28499824 | 0.81 | SMN1; SMN2 (0.51) | SMN1; SMN2RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL28496847 | 0.80 | SMN1; SMN2 (0.56) | SMN1; SMN2RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL28489351 | 0.80 | CYP3A4 (0.53) | SMN1; SMN2RAB9AKMT2AMEN1LMNA | |
| SCHEMBL30678946 | 0.79 | ALDH1A1 (0.47) | SMN1; SMN2RAB9ANPC1LMNACYP3A4 | |
| SCHEMBL179087 | 0.79 | LMNA (0.60) | SMN1; SMN2RAB9ANPC1KMT2AMEN1 | |
| SCHEMBL28487835 | 0.78 | RAB9A (0.65) | SMN1; SMN2RAB9ANPC1KMT2ALMNA |
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-112110932-B | Method for synthesizing phthalide tetrahydroisoquinoline compound by tandem cyclization strategy | 沈阳药科大学 | 2021-12-28 | — | — | CN | disclosed |
| CN-112110932-A | Method for synthesizing phthalide tetrahydroisoquinoline compound by tandem cyclization strategy | 沈阳药科大学 | 2020-12-22 | — | — | CN | disclosed |