Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CRHR1 | P34998 | 5/20 | 0.40 |
| ▸ | CRHR2 | Q13324 | 3/20 | 0.40 |
| ▸ | HTR1F | P30939 | 3/20 | 0.39 |
| ▸ | FASN | P49327 | 4/20 | 0.39 |
| ▸ | SMYD3 | Q9H7B4 | 2/20 | 0.38 |
| ▸ | HTR1A | P08908 | 2/20 | 0.38 |
| ▸ | HTR1D | P28221 | 2/20 | 0.38 |
| ▸ | HTR1B | P28222 | 2/20 | 0.38 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.37 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.36 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.36 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.36 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.36 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.36 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.36 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.36 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.36 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.36 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.36 |
| ▸ | BCHE | P06276 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL31411710 | 0.94 | CRHR1 (0.45) | CRHR1CRHR2FASN | |
| SCHEMBL31411703 | 0.91 | CRHR1 (0.39) | CRHR1CRHR2FASNSMYD3BCHE | |
| SCHEMBL31411561 | 0.88 | FASN (0.40) | CRHR1CRHR2FASN | |
| SCHEMBL31411685 | 0.82 | FASN (0.36) | CRHR1CRHR2FASNSMYD3HDAC2 | |
| SCHEMBL31411748 | 0.82 | FASN (0.36) | CRHR1CRHR2FASNSMYD3 | |
| SCHEMBL31411552 | 0.82 | CA12 (0.42) | — | |
| SCHEMBL31411617 | 0.82 | TP53 (0.48) | HDAC1 | |
| SCHEMBL31411640 | 0.81 | FASN (0.37) | CRHR1CRHR2FASN | |
| SCHEMBL31411761 | 0.78 | ALDH1A1 (0.40) | HTR1AHDAC2HDAC8HDAC6 | |
| SCHEMBL31411539 | 0.77 | KDM2B (0.45) | CRHR1CRHR2ACHE |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-119330982-A | Azetidine compound and medical application thereof | 中国科学院上海药物研究所 | 2025-01-21 | — | — | CN | disclosed |