Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.74 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.62 |
| ▸ | GAA | P10253 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.58 |
| ▸ | POLB | P06746 | 1/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.54 |
| ▸ | HCAR2 | Q8TDS4 | 4/20 | 0.52 |
| ▸ | HSD17B10 | Q99714 | 3/20 | 0.51 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | MAPK10 | P53779 | 2/20 | 0.50 |
| ▸ | NPC1 | O15118 | 1/20 | 0.50 |
| ▸ | RAB9A | P51151 | 1/20 | 0.50 |
| ▸ | LMNA | P02545 | 2/20 | 0.49 |
| ▸ | MAPT | P10636 | 1/20 | 0.49 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL8058385 | 0.86 | HCAR2 (0.69) | GAAPOLBHCAR2 | |
| SCHEMBL7108471 | 0.86 | KDM4E (1.00) | KDM4EALDH1A1GAAKMT2APOLB | |
| SCHEMBL8691529 | 0.81 | ALDH1A1 (0.60) | KDM4EALDH1A1GAAKMT2AHSD17B10 | |
| SCHEMBL30522452 | 0.81 | KDM4E (0.74) | KDM4EALDH1A1GAAKMT2AHCAR2 | |
| SCHEMBL22497428 | 0.81 | KDM4E (0.63) | KDM4EALDH1A1GAAKMT2APOLB | |
| SCHEMBL22524980 | 0.80 | KMT2A (0.50) | KDM4EALDH1A1GAAKMT2APOLB | |
| SCHEMBL8060436 | 0.80 | KMT2A (0.60) | KDM4EALDH1A1GAAKMT2AHSD17B10 | |
| SCHEMBL8689099 | 0.80 | L3MBTL1 (0.75) | KDM4EALDH1A1GAAKMT2ATSHR | |
| SCHEMBL14227308 | 0.79 | KDM4E (0.72) | KDM4EALDH1A1GAAKMT2AHCAR2 | |
| SCHEMBL9973826 | 0.78 | KDM4E (0.70) | KDM4EALDH1A1GAAKMT2AHCAR2 |
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-111763164-B | Preparation method and application of ortho-carbonyl amino substituted benzene derivatives | 中国医学科学院药物研究所 | 2023-03-10 | — | — | CN | disclosed |
| CN-111763164-A | Preparation method and application of ortho-carbonyl amino substituted benzene derivatives | 中国医学科学院药物研究所 | 2020-10-13 | — | — | CN | disclosed |
| WO-2020199945-A1 | ORTHO-CARBONYL AMINO-SUBSTITUTED BENZENE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 中国医学科学院药物研究所 | 2020-10-08 | — | — | WO | disclosed |
| WO-2020199945-A1 | ORTHO-CARBONYL AMINO-SUBSTITUTED BENZENE DERIVATIVE, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 中国医学科学院药物研究所 | 2020-10-08 | — | — | WO | disclosed |