SCHEMBL31444733

SCHEMBL31444733

CC(CCCCCCCC(C)(C)C)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ACE2 Q9BYF1 1/20 0.50
ACACB O00763 1/20 0.50
ACACA Q13085 1/20 0.50
LTA4H P09960 1/20 0.48
BLM P54132 1/20 0.48
GABRR1 P24046 2/20 0.45
CYP1A2 P05177 1/20 0.45
TBXAS1 P24557 2/20 0.42
FFAR1 O14842 2/20 0.39
CPT2 P23786 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
GPR84 Q9NQS5 3/20 0.36
CA1 P00915 1/20 0.36

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
SCHEMBL13062920 1.00 ACE2 (0.50) ACE2ACACBACACALTA4HBLM
SCHEMBL17431017 0.98 LTA4H (0.50) ACE2ACACBACACALTA4HBLM
SCHEMBL20825612 0.94 BLM (0.54) ACE2ACACBACACALTA4HBLM
SCHEMBL8848397 0.85 LTA4H (0.50) ACE2ACACBACACALTA4HBLM
SCHEMBL31073666 0.84 ACE2 (0.64) ACE2LTA4HBLMGABRR1CYP1A2
SCHEMBL20612872 0.84 ACE2 (0.64) ACE2LTA4HBLMGABRR1CYP1A2
SCHEMBL5977939 0.84 ACE2 (0.64) ACE2LTA4HBLMGABRR1CYP1A2
SCHEMBL9001608 0.84 ACE2 (0.64) ACE2LTA4HBLMGABRR1CYP1A2
SCHEMBL15183515 0.83 ACACB (0.48) ACE2ACACBACACATBXAS1FFAR1
SCHEMBL15183512 0.83 ACACB (0.48) ACE2ACACBACACATBXAS1FFAR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119698302-A Lipid nanoparticles 国立大学法人北海道大学 2025-03-25 CN disclosed