SCHEMBL22749152

SCHEMBL22749152

O=C(O)CC(O)(CC(=O)OC[C@@H](O)[C@@H](O)[C@H](O)[C@H](O)CO)C(=O)O.O=[NH+][O-]

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.34
PDE4A P27815 1/20 0.33
USP2 O75604 1/20 0.31
SLCO1B1 Q9Y6L6 1/20 0.31

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
SCHEMBL290076 0.93 ALDH1A1 (0.46) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL14423955 0.93 ALDH1A1 (0.46) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL2226410 0.93 ALDH1A1 (0.46) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL18585528 0.92 ALDH1A1 (0.44) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL4280799 0.92 ALDH1A1 (0.44) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL5355291 0.92 ALDH1A1 (0.44) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL1079363 0.90 ALDH1A1 (0.46) ALDH1A1LMNAPDE4AUSP2SLCO1B1
SCHEMBL18585615 0.90 ALDH1A1 (0.46) ALDH1A1LMNAPDE4AUSP2SLCO1B1
Water SCHEMBL2124480 0.86 ALDH1A1 (0.42) ALDH1A1PDE4A
Demannose SCHEMBL6062262 0.85 ALDH1A1 (0.38) ALDH1A1PDE4A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240016831-A1 NITRIC OXIDE OR NITRIC OXIDE RELEASING COMPOSITIONS FOR USE IN TREATING SARS-COV AND SARS-COV-2 Thirty Respiratory Limited (GB) 2024-01-18 US disclosed
US-20230172973-A1 METHODS AND COMPOSITIONS FOR TREATING AND COMBATTING TUBERCULOSIS Thirty Respiratory Limited (GB) 2023-06-08 US disclosed
CN-115884758-A Nitric oxide or nitric oxide-releasing compositions for the treatment of SARS-CoV and SARS-CoV-2 三十呼吸有限公司 2023-03-31 CN disclosed
CN-115768413-A Methods and compositions for treating and combating tuberculosis 三十呼吸有限公司 2023-03-07 CN disclosed
EP-4138794-A1 METHODS AND COMPOSITIONS FOR TREATING AND COMBATTING TUBERCULOSIS THIRTY RESPIRATORY LIMITED (GB) 2023-03-01 EP disclosed
US-20220370493-A1 METHODS AND COMPOSITIONS FOR GENERATING NITRIC OXIDE AND USES THEREOF Thirty Holdings Limited (GB) 2022-11-24 US disclosed
EP-3980373-A1 METHODS AND COMPOSITIONS FOR GENERATING NITRIC OXIDE AND USES THEREOF THIRTY HOLDINGS LIMITED (GB) 2022-04-13 EP disclosed
CN-114206325-A Methods and compositions for generating nitric oxide and uses thereof 三十控股有限公司 2022-03-18 CN disclosed
CN-114126629-A Methods and compositions for generating nitric oxide and uses thereof for delivery of nitric oxide via the respiratory tract 三十呼吸有限公司 2022-03-01 CN disclosed
WO-2021214439-A1 METHODS AND COMPOSITIONS FOR TREATING AND COMBATTING TUBERCULOSIS Thirty Respiratory Limited (GB) 2021-10-28 WO disclosed
WO-2020245573-A1 METHODS AND COMPOSITIONS FOR GENERATING NITRIC OXIDE AND USES THEREOF Thirty Holdings Limited (GB) 2020-12-10 WO disclosed