SCHEMBL29808745

SCHEMBL29808745

O=C(O)C(O)=C(O)C(O)C(O)CO.[Na]

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.43
LMNA P02545 2/20 0.40
USP2 O75604 1/20 0.35
SLCO1B1 Q9Y6L6 1/20 0.35
OR51E2 Q9H255 1/20 0.35
L3MBTL1 Q9Y468 1/20 0.33
TDP1 Q9NUW8 1/20 0.32

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
SCHEMBL677609 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL14940505 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL3764484 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL9246837 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL6542059 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL3764487 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL14940504 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL6542187 0.98 PDE4A (0.44) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL19952978 0.80 PDE4A (0.59) PDE4ALMNAUSP2SLCO1B1OR51E2
SCHEMBL258100 0.80 PDE4A (0.59) PDE4ALMNAUSP2SLCO1B1OR51E2

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.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114561258-B Cleaning agent for alkaline washing tower of ethylene device 浙江杭化科技股份有限公司 2023-11-17 CN claimed
CN-114561258-A Ethylene unit alkaline washing tower detergent 浙江杭化科技股份有限公司 2022-05-31 CN claimed
CN-114561258-B Cleaning agent for alkaline washing tower of ethylene device 浙江杭化科技股份有限公司 2023-11-17 CN disclosed
CN-114561258-A Ethylene unit alkaline washing tower detergent 浙江杭化科技股份有限公司 2022-05-31 CN disclosed