SCHEMBL29784689

SCHEMBL29784689

Nc1nc(SCc2ccc([N+](=O)[O-])cc2)c2ncn([C@@H]3O[C@H](CO)[C@@H](O)[C@H]3O)c2n1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC29A1 Q99808 15/20 1.00
CYP3A4 P08684 2/20 1.00
LMNA P02545 1/20 1.00
RAB9A P51151 1/20 1.00
PKM P14618 1/20 1.00
HPGD P15428 1/20 1.00
SMN1; SMN2 Q16637 1/20 1.00
TP53 P04637 1/20 0.77
HIF1A Q16665 1/20 0.77
ABCC4 O15439 1/20 0.77
SLC28A3 Q9HAS3 1/20 0.77
BLM P54132 1/20 0.77

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.

Compoundsimilaritytop predictedshared targets
SCHEMBL1322160 1.00 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
SCHEMBL20579724 1.00 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
SCHEMBL4351105 0.88 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
Nitrobenzylmercaptopurine Ribonucleoside SCHEMBL290702 0.87 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
Nitrobenzylmercaptopurine Ribonucleoside SCHEMBL7617534 0.87 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
Nitrobenzylmercaptopurine Ribonucleoside SCHEMBL1321676 0.87 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
Nitrobenzylmercaptopurine Ribonucleoside SCHEMBL29374837 0.87 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
SCHEMBL31462888 0.87 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
SCHEMBL6761745 0.87 SLC29A1 (1.00) SLC29A1CYP3A4LMNARAB9APKM
SCHEMBL20769890 0.83 SLC29A1 (0.71) SLC29A1CYP3A4LMNARAB9APKM

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 15 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115003669-B Compounds and their use for the treatment of alpha1Use of antitrypsin deficiency 森特萨制药(英国)有限公司 2024-10-25 CN disclosed
CN-115003381-B Compounds and their use for the treatment of alpha 1-antitrypsin deficiency 森特萨制药(英国)有限公司 2024-07-26 CN disclosed
CN-115003658-B Compounds and their use for the treatment of alpha1Use of antitrypsin deficiency 森特萨制药(英国)有限公司 2024-07-23 CN disclosed
CN-115023416-B 4- ((2-oxopyridin-1 (2H) -yl) methyl) benzamide for the treatment of alpha 1-antitrypsin deficiency 森特萨制药(英国)有限公司 2024-04-02 CN disclosed
CN-115003380-B Compounds and their use for the treatment of alpha 1-antitrypsin deficiency 森特萨制药(英国)有限公司 2024-04-02 CN disclosed
CN-117794538-A For the treatment of alpha 1 Composition for anti-trypsin deficiency and use thereof 森特萨制药(英国)有限公司 2024-03-29 CN disclosed
EP-4073040-A1 4-((2-OXOPYRI DIN-1 (2H)-YL)METHYL)BENZAMIDES FOR TREATING ALPHA1 -ANTITRYPSIN DEFICIENCY Z Factor Limited (GB) 2022-10-19 EP disclosed
EP-4072675-A1 COMPOUNDS AND THEIR USE FOR THE TREATMENT OF ALPHA1-ANTITRYPSIN DEFICIENCY Z Factor Limited (GB) 2022-10-19 EP disclosed
EP-4073043-A1 COMPOUNDS AND THEIR USE FOR THE TREATMENT OF ALPHA1-ANTITRYPSIN DEFICIENCY Z Factor Limited (GB) 2022-10-19 EP disclosed
EP-4073068-A1 COMPOUNDS AND THEIR USE FOR THE TREATMENT OF a1-ANTITRYPSIN DEFICIENCY Z Factor Limited (GB) 2022-10-19 EP disclosed
EP-4072671-A1 COMPOUNDS AND THEIR USE FOR THE TREATMENT OF a1-ANTITRYPSIN DEFICIENCY Z Factor Limited (GB) 2022-10-19 EP disclosed
CN-115023416-A 4- ((2-oxopyridin-1 (2H) -yl) methyl) benzamides for the treatment of alpha 1-antitrypsin deficiency Z因子有限公司 2022-09-06 CN disclosed
CN-115003669-A Compounds and their use in the treatment of alpha 1 Use against trypsin deficiency Z因子有限公司 2022-09-02 CN disclosed
CN-115003381-A Compounds and their use for the treatment of alpha 1-antitrypsin deficiency Z因子有限公司 2022-09-02 CN disclosed
CN-115003380-A Compounds and their use for the treatment of alpha 1-antitrypsin deficiency Z因子有限公司 2022-09-02 CN disclosed