SCHEMBL6454859

SCHEMBL6454859

CCCCCCCC1CCC2CC(c3cc(F)c(-c4ccc(C)cc4)c(F)c3)CCC2C1

nearest known ligand 0.33

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
PDE9A O76083 1/20 0.30
TP53 P04637 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
SCHEMBL6454857 1.00 GAA (0.33) GAAMAPTMEN1KMT2APDE9A
SCHEMBL6461525 1.00 GAA (0.33) GAAMAPTMEN1KMT2APDE9A
SCHEMBL6461521 1.00 GAA (0.33) GAAMAPTMEN1KMT2APDE9A
SCHEMBL6460364 0.99 GAA (0.32) GAAMAPTMEN1KMT2APDE9A
SCHEMBL6460361 0.99 GAA (0.32) GAAMAPTMEN1KMT2APDE9A
SCHEMBL6452354 0.96 PDE9A (0.33) PDE9ATP53
SCHEMBL6452357 0.96 PDE9A (0.33) PDE9ATP53
SCHEMBL6454223 0.92 PTGS1 (0.34) GAAMAPTMEN1KMT2ATP53
SCHEMBL6458881 0.92 PTGS1 (0.34) GAAMAPTMEN1KMT2ATP53
SCHEMBL6458886 0.92 PTGS1 (0.34) GAAMAPTMEN1KMT2ATP53

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