SCHEMBL5349503

SCHEMBL5349503

COC1CCCCC1(O)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.43
SLC6A2 P23975 7/20 0.42
SLC6A4 P31645 7/20 0.42
OPRM1 P35372 4/20 0.42
SLC22A1 O15245 3/20 0.42
OPRD1 P41143 2/20 0.42
OPRK1 P41145 2/20 0.42
MEN1 O00255 2/20 0.42
KMT2A Q03164 2/20 0.42
CHRM2 P08172 1/20 0.42
CHRM1 P11229 1/20 0.42
DPP4 P27487 1/20 0.40
CNR2 P34972 3/20 0.39
NPY1R P25929 1/20 0.39
HTT P42858 1/20 0.39
NPY2R P49146 1/20 0.39
CNR1 P21554 1/20 0.39
SLC6A3 Q01959 1/20 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
SCHEMBL14842579 0.86 CNR2 (0.40) MAPTSLC6A2SLC6A4OPRM1SLC22A1
SCHEMBL9398875 0.84 MAPT (0.41) MAPTSLC6A2SLC6A4OPRM1SLC22A1
SCHEMBL28740691 0.83 SLC6A2 (0.41) MAPTSLC6A2SLC6A4OPRM1SLC22A1
SCHEMBL9328997 0.82 CHRM2 (0.47) MAPTSLC6A2SLC6A4OPRM1SLC22A1
SCHEMBL9219188 0.82 CHRM2 (0.47) MAPTSLC6A2SLC6A4OPRM1SLC22A1
SCHEMBL9219191 0.82 CHRM2 (0.47) MAPTSLC6A2SLC6A4OPRM1SLC22A1
SCHEMBL588342 0.81 CNR2 (0.41) SLC6A2SLC6A4OPRM1OPRD1OPRK1
SCHEMBL11465118 0.77 MAPT (0.54) MAPTSLC6A2SLC6A4OPRM1OPRD1
SCHEMBL9618282 0.77 SLC6A9 (0.41) SLC6A2SLC6A4OPRM1SLC22A1OPRD1
SCHEMBL9329144 0.77 CNR1 (0.42) MAPTMEN1KMT2ACNR2CNR1

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
US-7273952-B2 Substituted C-cyclohexylmethylamine derivatives GRUENENTHAL GMBH (DE) 2007-09-25 US disclosed