SCHEMBL5535453

SCHEMBL5535453

C=CC(=O)C(=O)[C@H](O)[C@@H](O)[C@H](O)[C@H](O)CO

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PDE4A P27815 1/20 0.52
LMNA P02545 2/20 0.48
L3MBTL1 Q9Y468 1/20 0.44
TDP1 Q9NUW8 1/20 0.42
USP2 O75604 1/20 0.39
SLCO1B1 Q9Y6L6 1/20 0.39
KDM4E B2RXH2 2/20 0.33

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
SCHEMBL5534607 1.00 PDE4A (0.52) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL5682504 0.81 USP2 (0.55) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL2687657 0.80 PDE4A (0.68) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL18452554 0.79 PDE4A (0.56) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL27810471 0.79 PDE4A (0.56) PDE4ALMNAL3MBTL1TDP1USP2
Acrylic Acid SCHEMBL28362068 0.78 PDE4A (0.50) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL27904868 0.77 PDE4A (0.58) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL9169459 0.77 KDM4E (0.40) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL29206786 0.76 PDE4A (0.62) PDE4ALMNAL3MBTL1TDP1USP2
SCHEMBL7637773 0.76 PDE4A (0.62) PDE4ALMNAL3MBTL1TDP1USP2

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-113840801-B Method for ultra-fast growth of graphene 国家纳米科学中心 2024-04-16 CN disclosed
CN-109675104-B Preparation method of mineralized hydrogel and biomimetic mineralized bone repair material 四川大学 2020-08-14 CN disclosed
US-20070059828-A1 Carrier for nucleic acid molecule delivery YAMAOKA, TETSUJI (JP) 2007-03-15 US disclosed
EP-0173517-A2 Process for producing essentially homopolymer-free saccharide graft polymers and saccharide graft polymers obtainable thereby CPC INTERNATIONAL INC. (US) 1986-03-05 EP disclosed