Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTT | P42858 | 2/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.55 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | TSHR | P16473 | 2/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.52 |
| ▸ | MMP8 | P22894 | 1/20 | 0.48 |
| ▸ | MMP12 | P39900 | 1/20 | 0.48 |
| ▸ | MMP13 | P45452 | 1/20 | 0.48 |
| ▸ | BMP1 | P13497 | 2/20 | 0.46 |
| ▸ | CNR2 | P34972 | 1/20 | 0.46 |
| ▸ | CYP19A1 | P11511 | 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 | |
|---|---|---|---|---|
| SCHEMBL28738756 | 0.95 | HTT (0.55) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL1493676 | 0.90 | HTT (0.59) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL6831298 | 0.86 | HTT (0.55) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL1484511 | 0.86 | HTT (0.55) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL22230464 | 0.85 | HTT (0.65) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL10370858 | 0.83 | HTT (0.58) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL28356040 | 0.82 | HTT (0.51) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL8413524 | 0.82 | HTT (0.65) | HTTSMN1; SMN2LMNATSHRALDH1A1 | |
| SCHEMBL195152 | 0.80 | CA2 (0.55) | HTTALDH1A1 | |
| SCHEMBL28352284 | 0.79 | HTT (0.54) | HTTSMN1; SMN2LMNATSHRALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-112867722-B | MACROCYCLIC SPIROETHERS (MACROCYCLIC SPIROETHERS) as MCL-1 inhibitors | 苏州亚盛药业有限公司 | 2022-09-23 | — | — | CN | disclosed |
| CN-112867722-A | MACROCYCLIC SPIROETHERS (MACROCYCLIC SPIROETHERS) as MCL-1 inhibitors | 苏州亚盛药业有限公司 | 2021-05-28 | — | — | CN | disclosed |
| EP-3781574-A1 | MACROCYCLIC SPIROETHERS AS MCL-1 INHIBITORS | Ascentage Pharma (Suzhou) Co., Ltd. (CN) | 2021-02-24 | — | — | EP | disclosed |
| WO-2020147802-A1 | MACROCYCLIC SPIROETHERS AS MCL-1 INHIBITORS | ASCENTAGE PHARMA (SUZHOU) CO., LTD. (CN) | 2020-07-23 | — | — | WO | disclosed |