SCHEMBL6459367

SCHEMBL6459367

CCCC1CCC2C[C@H](C(=O)O)CC[C@@H]2C1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
PLG P00747 1/20 0.41
PLAT P00750 1/20 0.41
TLR4 O00206 2/20 0.40
ANPEP P15144 1/20 0.34
ENPEP Q07075 1/20 0.34
CYP2C9 P11712 1/20 0.33
ACE P12821 1/20 0.33
GRIN2D O15399 1/20 0.33
GRIN3B O60391 1/20 0.33
GRIA1 P42261 1/20 0.33
GRIA2 P42262 1/20 0.33
GRIA3 P42263 1/20 0.33
GRIA4 P48058 1/20 0.33
GRIN1 Q05586 1/20 0.33
GRIN2A Q12879 1/20 0.33
GRIN2B Q13224 1/20 0.33
GRIN2C Q14957 1/20 0.33
GRIN3A Q8TCU5 1/20 0.33
TP53 P04637 1/20 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
SCHEMBL5599221 1.00 LMNA (0.41) LMNAPLGPLATTLR4ANPEP
SCHEMBL5599223 1.00 LMNA (0.41) LMNAPLGPLATTLR4ANPEP
SCHEMBL5884828 0.92 LMNA (0.38) LMNAPLGPLATTLR4ANPEP
SCHEMBL5884833 0.92 LMNA (0.38) LMNAPLGPLATTLR4ANPEP
SCHEMBL5684480 0.92 LMNA (0.38) LMNAPLGPLATTLR4ANPEP
SCHEMBL6461803 0.91 PLG (0.44) LMNAPLGPLATTLR4ANPEP
SCHEMBL7917053 0.91 PLG (0.44) LMNAPLGPLATTLR4ANPEP
SCHEMBL6461806 0.91 PLG (0.44) LMNAPLGPLATTLR4ANPEP
SCHEMBL11208792 0.90 POLB (0.43) LMNAPLGPLATTLR4CYP2C9
SCHEMBL11208791 0.90 POLB (0.43) LMNAPLGPLATTLR4CYP2C9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6913797-B1 Decahydronaphthalene derivative DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-07-05 US disclosed
EP-1108700-A1 DECAHYDRONAPHTHALENE DERIVATIVE DAINIPPON INK AND CHEMICALS, INC. (JP) 2001-06-20 EP disclosed
US-4391731-A Hydrogenated naphthalenes HOFFMANN-LA ROCHE INC. (US) 1983-07-05 US disclosed