SCHEMBL26601099

SCHEMBL26601099

CCC1OC(=O)C(O[C@@H]2O[C@H](CO)[C@@H](O)[C@H](O)[C@H]2O)=C1C

nearest known ligand 0.47

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 1/20 0.47
▸ SLC5A2 P31639 2/20 0.46
▸ POLB P06746 1/20 0.46
▸ MEN1 O00255 1/20 0.46
▸ KMT2A Q03164 1/20 0.46
▸ SLC28A3 Q9HAS3 2/20 0.45
▸ EPHX2 P34913 1/20 0.44
▸ CA12 O43570 4/20 0.44
▸ CA9 Q16790 4/20 0.44
▸ CA1 P00915 3/20 0.44
▸ CA7 P43166 1/20 0.44
▸ CA13 Q8N1Q1 1/20 0.44
▸ TYR P14679 1/20 0.44
▸ ACHE P22303 1/20 0.43
▸ CA2 P00918 1/20 0.43

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
SCHEMBL26601048 0.84 ALDH1A1 (0.49) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL22882206 0.84 ALDH1A1 (0.49) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL26601389 0.75 ALDH1A1 (0.48) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL14514190 0.73 ALDH1A1 (0.45) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL14514176 0.73 ALDH1A1 (0.45) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL26600978 0.72 ALDH1A1 (0.48) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL25632421 0.71 POLB (0.49) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL23552257 0.70 SLC28A3 (0.47) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL14514178 0.70 ALDH1A1 (0.46) ALDH1A1SLC5A2POLBMEN1KMT2A
SCHEMBL25632110 0.70 SLC28A3 (0.47) ALDH1A1SLC5A2POLBMEN1KMT2A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240008524-A1 CONSUMABLE Nicoventures Trading Limited (GB) 2024-01-11 — — US disclosed
US-20230337719-A1 ORAL PRODUCT NICOVENTURES TRADING LTD (GB) 2023-10-26 — — US disclosed
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