Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM4E | B2RXH2 | 7/20 | 0.59 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.59 |
| ▸ | LMNA | P02545 | 5/20 | 0.59 |
| ▸ | HPGD | P15428 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | AOX1 | Q06278 | 1/20 | 0.59 |
| ▸ | TRIM24 | O15164 | 1/20 | 0.57 |
| ▸ | TRIM33 | Q9UPN9 | 1/20 | 0.57 |
| ▸ | ESR1 | P03372 | 1/20 | 0.49 |
| ▸ | PTGS1 | P23219 | 1/20 | 0.49 |
| ▸ | ACP1 | P24666 | 1/20 | 0.49 |
| ▸ | PDE4A | P27815 | 1/20 | 0.49 |
| ▸ | P2RX1 | P51575 | 1/20 | 0.49 |
| ▸ | P2RX2 | Q9UBL9 | 1/20 | 0.49 |
| ▸ | PDXK | O00764 | 1/20 | 0.46 |
| ▸ | ERN1 | O75460 | 4/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.36 |
| ▸ | HTT | P42858 | 4/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL8265770 | 0.80 | KDM4E (0.62) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL11011837 | 0.79 | KDM4E (0.57) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL8835556 | 0.77 | KDM4E (0.59) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL10295492 | 0.76 | KDM4E (0.77) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL14688193 | 0.75 | ALDH1A1 (0.53) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL14687825 | 0.75 | KDM4E (0.53) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL14688195 | 0.75 | ALDH1A1 (0.53) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL9656217 | 0.74 | KDM4E (0.42) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| Pyridoxal SCHEMBL29906 | 0.74 | KDM4E (1.00) | KDM4EALDH1A1LMNAHPGDMEN1 | |
| SCHEMBL17224491 | 0.74 | KDM4E (0.56) | KDM4EALDH1A1LMNAHPGDMEN1 |
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-3953334-B1 | NOVEL SYNTHETIC OPTIONS TOWARDS THE MANUFACTURE OF (6R,10S)-10- {4-[5-CHLORO-2-(4-CHLORO-1H-1,2,3-TRIAZOL-1-YL)PHENYL]-6-OXO-1(6H)- PYRIMIDINYL}- 1-(DIFLUOROMETHYL)-6-METHYL-1,4,7,8,9,10-HEXAHYDRO-11,15 -(METHENO)PYRAZOLO [4,3-B] [1,7] DIAZACYCLOTETRADECIN-5(6H)-ONE | BRISTOL MYERS SQUIBB CO (US) | 2023-11-22 | — | — | EP | claimed |