SCHEMBL6463565

SCHEMBL6463565

CCCC1CC[C@@H]2C[C@H](CCc3ccc(Cl)cc3)CC[C@@H]2C1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.43
FAAH O00519 1/20 0.38
SLC6A3 Q01959 1/20 0.38
MAOA P21397 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.38
KMT2A Q03164 1/20 0.36
TAAR1 Q96RJ0 2/20 0.36
DRD2 P14416 2/20 0.36
DRD3 P35462 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
POLB P06746 1/20 0.36
GAA P10253 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.36
KCNH2 Q12809 1/20 0.35

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
SCHEMBL6463567 1.00 MAOB (0.43) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL5683705 0.93 MAOB (0.41) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL5683700 0.93 MAOB (0.41) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL8380859 0.90 MAOB (0.49) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL8414796 0.90 MAOB (0.49) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL8414794 0.90 MAOB (0.49) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL9133245 0.89 MAOB (0.53) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL10381925 0.89 MAOB (0.53) MAOBFAAHSLC6A3MAOAL3MBTL1
SCHEMBL6451679 0.84 MAOB (0.43) MAOBMAOATAAR1
SCHEMBL6460078 0.84 MAOB (0.38) MAOBMAOA

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