SCHEMBL6456142

SCHEMBL6456142

CCCC1CC[C@@H]2C[C@H](c3cc(F)c(-c4ccc(OC(F)F)c(F)c4)c(F)c3)CC[C@@H]2C1

nearest known ligand 0.30

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PDE4B Q07343 1/20 0.30
KDM1A O60341 2/20 0.30
BACE1 P56817 1/20 0.30
GRM2 Q14416 1/20 0.30
FPR2 P25090 1/20 0.30

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
SCHEMBL6456144 1.00 PDE4B (0.30) PDE4BKDM1ABACE1GRM2FPR2
SCHEMBL6455848 0.94 MGLL (0.31)
SCHEMBL6455847 0.94 MGLL (0.31)
SCHEMBL6453556 0.93 MGLL (0.31)
SCHEMBL6453559 0.93 MGLL (0.31)
SCHEMBL6463441 0.92 MGLL (0.32)
SCHEMBL6460567 0.92 MGLL (0.32)
SCHEMBL6463439 0.92 MGLL (0.32)
SCHEMBL6460570 0.92 MGLL (0.32)
SCHEMBL6453460 0.92 GRIN1 (0.32) PDE4BKDM1AGRM2

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-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