SCHEMBL28002157

SCHEMBL28002157

CCCCC1CCCCC1(O)c1ccccc1

nearest known ligand 0.47

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
SLC6A4 P31645 10/20 0.47
SLC6A2 P23975 9/20 0.47
OPRM1 P35372 8/20 0.47
OPRD1 P41143 3/20 0.47
OPRK1 P41145 3/20 0.47
KMT2A Q03164 3/20 0.47
MEN1 O00255 2/20 0.47
SLC22A1 O15245 3/20 0.44
CHRM2 P08172 1/20 0.44
CHRM1 P11229 1/20 0.44
SLC6A9 P48067 1/20 0.42
ALDH1A1 P00352 2/20 0.40
LMNA P02545 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
NPY1R P25929 1/20 0.39
HTT P42858 1/20 0.39
NPY2R P49146 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
SCHEMBL4989694 0.84 SLC6A2 (0.51) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL547417 0.84 OPRM1 (0.41) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL547562 0.84 OPRM1 (0.41) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL898941 0.80 SLC6A2 (0.49) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL898940 0.80 SLC6A2 (0.49) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL21483713 0.78 SLC6A2 (0.42) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL28562635 0.78 OPRM1 (0.40) SLC6A4SLC6A2OPRM1SLC6A9
SCHEMBL28051310 0.78 SLC6A4 (0.38) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL28739214 0.78 SLC22A1 (0.68) SLC6A4SLC6A2OPRM1OPRD1OPRK1
SCHEMBL150032 0.78 SLC6A4 (0.73) SLC6A4SLC6A2OPRM1OPRD1OPRK1

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
CN-104311377-A Synthesis method of biphenyl compounds UNIV ZHEJIANG TECHNOLOGY 2015-01-28 CN disclosed