SCHEMBL17469111

SCHEMBL17469111

CCN1Cc2ccccc2OC(c2cccc(Br)c2)C1

nearest known ligand 0.44

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
DRD3 P35462 4/20 0.40
DRD2 P14416 1/20 0.40
DRD1 P21728 1/20 0.40
DRD4 P21917 1/20 0.40
DRD5 P21918 1/20 0.40
L3MBTL3 Q96JM7 1/20 0.37
FFAR1 O14842 3/20 0.36
KDM1A O60341 1/20 0.35
RCOR1 Q9UKL0 1/20 0.35
KIF11 P52732 1/20 0.35
HTR2A P28223 3/20 0.34
HTR2C P28335 3/20 0.34
HTR2B P41595 3/20 0.34
HRH3 Q9Y5N1 3/20 0.34
SLC6A2 P23975 1/20 0.34
SLC6A4 P31645 1/20 0.34
SLC6A3 Q01959 1/20 0.34
HSD17B3 P37058 1/20 0.34

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
SCHEMBL17459287 0.86 LTA4H (0.38) SLC6A2SLC6A4SLC6A3
SCHEMBL17469027 0.86 MAOB (0.42) DRD3KIF11SLC6A2SLC6A4SLC6A3
SCHEMBL17468345 0.86 MAOB (0.42) DRD3KIF11SLC6A2SLC6A4SLC6A3
SCHEMBL17469146 0.85 DRD3 (0.40) DRD3FFAR1KIF11HTR2AHTR2C
SCHEMBL17459422 0.83 LMNA (0.48) DRD3DRD2SLC6A2SLC6A4SLC6A3
SCHEMBL17468919 0.82 DRD3 (0.50) DRD3DRD2
SCHEMBL17469121 0.81 SLC6A4 (0.42) DRD3DRD2SLC6A2SLC6A4SLC6A3
SCHEMBL17469153 0.81 HTR2C (0.38) DRD3FFAR1KIF11HTR2CHRH3
SCHEMBL17459339 0.80 SLC22A12 (0.34) DRD3SLC6A2SLC6A4SLC6A3HSD17B3
SCHEMBL17459309 0.79 LTA4H (0.40) HRH3SLC6A2SLC6A4SLC6A3

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-2016012333-A1 PESTICIDAL COMPOUNDS SYNGENTA PARTICIPATIONS AG (CH) 2016-01-28 WO disclosed