Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 5/20 | 0.46 |
| ▸ | L3MBTL1 | Q9Y468 | 5/20 | 0.46 |
| ▸ | RAB9A | P51151 | 5/20 | 0.46 |
| ▸ | NPC1 | O15118 | 4/20 | 0.46 |
| ▸ | MAPT | P10636 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.46 |
| ▸ | HPGD | P15428 | 2/20 | 0.46 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.41 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.41 |
| ▸ | NFKB1 | P19838 | 2/20 | 0.41 |
| ▸ | NFKB2 | Q00653 | 2/20 | 0.41 |
| ▸ | RELA | Q04206 | 2/20 | 0.41 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.41 |
| ▸ | STAT1 | P42224 | 1/20 | 0.41 |
| ▸ | F2 | P00734 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.41 |
| ▸ | MIF | P14174 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL24701997 | 0.84 | L3MBTL1 (0.42) | ALDH1A1SMN1; SMN2L3MBTL1RAB9ANPC1 | |
| SCHEMBL24702068 | 0.79 | TSHR (0.45) | ALDH1A1SMN1; SMN2L3MBTL1HPGDTDP1 | |
| SCHEMBL17993796 | 0.74 | TSHR (0.51) | ALDH1A1SMN1; SMN2L3MBTL1RAB9AKDM4E | |
| SCHEMBL14330665 | 0.73 | ACSS2 (0.40) | ALDH1A1SMN1; SMN2L3MBTL1RAB9ANPC1 | |
| SCHEMBL14331601 | 0.72 | TP53 (0.45) | ALDH1A1SMN1; SMN2KDM4EHPGDKMT2A | |
| SCHEMBL14330657 | 0.72 | ALDH1A1 (0.42) | ALDH1A1SMN1; SMN2RAB9ANPC1MAPT | |
| SCHEMBL3001120 | 0.70 | ALOX5 (0.46) | ALDH1A1SMN1; SMN2L3MBTL1RAB9ANPC1 | |
| SCHEMBL14352068 | 0.69 | KMT2A (0.49) | ALDH1A1L3MBTL1RAB9ANPC1MAPT | |
| SCHEMBL28861756 | 0.68 | TSHR (0.53) | ALDH1A1SMN1; SMN2L3MBTL1RAB9ANPC1 | |
| SCHEMBL27480439 | 0.68 | CHRNB2 (0.54) | SMN1; SMN2L3MBTL1TDP1TSHRCYP1A2 |
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 |
|---|---|---|---|---|---|---|---|
| EP-4101843-A1 | METHOD FOR PRODUCING AROMATIC HETEROCYCLIC RING-SUBSTITUTED DIFLUOROACETIC ACID DERIVATIVE | AGC INC. (JP) | 2022-12-14 | — | — | EP | disclosed |