SCHEMBL6458661

SCHEMBL6458661

CCCC1CCC2CC(c3ccc(-c4cc(F)c(C5=NC(C)(C)CO5)c(F)c4)cc3)CCC2C1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.36
MAPT P10636 1/20 0.36
HTT P42858 1/20 0.36
CYP2D6 P10635 1/20 0.31
HRH3 Q9Y5N1 1/20 0.31
CYP2C9 P11712 1/20 0.31
IL2 P60568 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
SCHEMBL6458656 1.00 LMNA (0.36) LMNAMAPTHTTCYP2D6HRH3
SCHEMBL6454210 0.94 LMNA (0.35) LMNAMAPTHTTCYP2D6HRH3
SCHEMBL6454216 0.94 LMNA (0.35) LMNAMAPTHTTCYP2D6HRH3
SCHEMBL6464324 0.94 MAPT (0.34) LMNAMAPTHTTCYP2D6HRH3
SCHEMBL6464328 0.94 MAPT (0.34) LMNAMAPTHTTCYP2D6HRH3
SCHEMBL6458665 0.93 MAPT (0.34) LMNAMAPTHTT
SCHEMBL6453355 0.93 MAPT (0.34) LMNAMAPTHTT
SCHEMBL6458671 0.93 MAPT (0.34) LMNAMAPTHTT
SCHEMBL6453360 0.93 MAPT (0.34) LMNAMAPTHTT
SCHEMBL6458977 0.92 LMNA (0.37) LMNAMAPTHTTCYP2D6HRH3

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