Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.56 |
| ▸ | MAPT | P10636 | 3/20 | 0.56 |
| ▸ | PAX8 | Q06710 | 2/20 | 0.56 |
| ▸ | CYP24A1 | Q07973 | 2/20 | 0.56 |
| ▸ | GAA | P10253 | 1/20 | 0.56 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.56 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.56 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.53 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.53 |
| ▸ | TNF | P01375 | 3/20 | 0.49 |
| ▸ | IL6 | P05231 | 3/20 | 0.49 |
| ▸ | MEN1 | O00255 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.45 |
| ▸ | P4HB | P07237 | 1/20 | 0.45 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | EGFR | P00533 | 4/20 | 0.43 |
| ▸ | ACHE | P22303 | 3/20 | 0.43 |
| ▸ | CYP26A1 | O43174 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL7651444 | 0.74 | TNF (0.66) | MAPTCYP24A1SMN1; SMN2KDM4ELMNA | |
| SCHEMBL28032005 | 0.74 | CYP24A1 (0.65) | ALDH1A1MAPTCYP24A1GAASMN1; SMN2 | |
| SCHEMBL28031993 | 0.70 | TNF (0.69) | ALDH1A1MAPTCYP24A1GAAKMT2A | |
| SCHEMBL28031997 | 0.70 | TNF (0.69) | ALDH1A1MAPTCYP24A1GAAKMT2A | |
| SCHEMBL16769894 | 0.69 | ALDH1A1 (1.00) | ALDH1A1MAPTPAX8GAASMN1; SMN2 | |
| SCHEMBL16755556 | 0.69 | ALDH1A1 (1.00) | ALDH1A1MAPTPAX8GAASMN1; SMN2 | |
| SCHEMBL16755558 | 0.69 | ALDH1A1 (1.00) | ALDH1A1MAPTPAX8GAASMN1; SMN2 | |
| SCHEMBL12485678 | 0.69 | MAOB (0.50) | ALDH1A1MAPTCYP24A1GAASMN1; SMN2 | |
| SCHEMBL14119825 | 0.67 | TNF (1.00) | ALDH1A1MAPTCYP24A1GAASMN1; SMN2 | |
| SCHEMBL14119823 | 0.67 | TNF (1.00) | ALDH1A1MAPTCYP24A1GAASMN1; SMN2 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105037252-A | N-substituted-3,5-bis(2-trifluoromethyl)benzal)piperidine-4-one derivative, preparation method and application thereof | UNIV WENZHOU MEDICAL | 2015-11-11 | — | — | CN | claimed |
| CN-105037252-B | N- substitutions -3,5- two (2- (trifluoromethyl) benzal) piperidin-4-one-derivative and preparation method and application | 温州医科大学 | 2018-05-04 | — | — | CN | disclosed |
| CN-105037252-A | N-substituted-3,5-bis(2-trifluoromethyl)benzal)piperidine-4-one derivative, preparation method and application thereof | UNIV WENZHOU MEDICAL | 2015-11-11 | — | — | CN | disclosed |