Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.47 |
| ▸ | MC4R | P32245 | 4/20 | 0.44 |
| ▸ | MC5R | P33032 | 3/20 | 0.44 |
| ▸ | MC3R | P41968 | 3/20 | 0.44 |
| ▸ | PIN1 | Q13526 | 1/20 | 0.42 |
| ▸ | SLC7A5 | Q01650 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | LMNA | P02545 | 1/20 | 0.39 |
| ▸ | POLB | P06746 | 1/20 | 0.39 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.38 |
| ▸ | TSPO | P30536 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
| ▸ | GLA | P06280 | 1/20 | 0.37 |
| ▸ | TMEM97 | Q5BJF2 | 1/20 | 0.37 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL6791114 | 0.89 | MC4R (0.50) | MC4RMC5RMC3RPIN1SLC7A5 | |
| SCHEMBL6791119 | 0.89 | MC4R (0.50) | MC4RMC5RMC3RPIN1SLC7A5 | |
| SCHEMBL25403058 | 0.80 | CTSS (0.56) | PTGES | |
| SCHEMBL8155355 | 0.79 | PIN1 (0.45) | MC4RMC5RMC3RPIN1ALDH1A1 | |
| SCHEMBL8732931 | 0.79 | PIN1 (0.45) | MC4RMC5RMC3RPIN1ALDH1A1 | |
| SCHEMBL8123534 | 0.79 | MEN1 (0.43) | PTGESMC4RMC5RMC3RPIN1 | |
| SCHEMBL11132463 | 0.78 | SLC7A5 (0.45) | SLC7A5CYP19A1 | |
| SCHEMBL27565891 | 0.77 | PIN1 (0.47) | PIN1ALDH1A1LMNAPOLBHSD17B10 | |
| SCHEMBL6298201 | 0.77 | PIN1 (0.47) | PIN1ALDH1A1LMNAPOLBHSD17B10 | |
| SCHEMBL1883119 | 0.76 | PIN1 (0.51) | PIN1ALDH1A1LMNAPOLBHSD17B10 |
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-118742539-A | Heterocyclic derivative and preparation method and application thereof | 浙江海正药业股份有限公司 | 2024-10-01 | — | — | CN | disclosed |
| WO-2023169391-A1 | HETEROCYCLIC DERIVATIVE, PREPARATION METHOD THEREFOR, AND USE THEREOF | 浙江海正药业股份有限公司 | 2023-09-14 | — | — | WO | disclosed |