SCHEMBL10381925

SCHEMBL10381925

CCCC1CCC(CCc2ccc(Cl)cc2)CC1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAOB P27338 3/20 0.53
MAOA P21397 1/20 0.45
FAAH O00519 1/20 0.45
SLC6A3 Q01959 2/20 0.42
L3MBTL1 Q9Y468 1/20 0.42
TAAR1 Q96RJ0 2/20 0.41
SLC6A2 P23975 1/20 0.41
HTR2A P28223 1/20 0.41
SLC6A4 P31645 1/20 0.41
HRH1 P35367 1/20 0.41
HTR2B P41595 1/20 0.41
CHRNA4 P43681 1/20 0.41
KDM4E B2RXH2 1/20 0.40
ALDH1A1 P00352 1/20 0.40
POLB P06746 1/20 0.40
GAA P10253 1/20 0.40
CTDSP1 Q9GZU7 1/20 0.40
DRD2 P14416 2/20 0.40
DRD3 P35462 2/20 0.40
KCNH2 Q12809 2/20 0.39

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
SCHEMBL9133245 1.00 MAOB (0.53) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL7770647 0.95 MAOB (0.49) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL7770649 0.95 MAOB (0.49) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL8414794 0.95 MAOB (0.49) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL8414796 0.95 MAOB (0.49) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL8380859 0.95 MAOB (0.49) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL8452519 0.91 MAOB (0.51) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL8452524 0.91 MAOB (0.51) MAOBMAOAFAAHSLC6A3L3MBTL1
SCHEMBL10899324 0.90 MAOB (0.51) MAOBMAOAALDH1A1
SCHEMBL10899319 0.90 MAOB (0.51) MAOBMAOAALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1990014405-A1 CHLOROBENZENE DERIVATIVES MERCK Patent Gesellschaft mit beschränkter Haftung (DE) 1990-11-29 WO disclosed