SCHEMBL17469153

SCHEMBL17469153

CCN1Cc2ccccc2OC(c2cccc(-c3ccc(Cl)cc3)c2)C1

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 1/20 0.38
DRD3 P35462 3/20 0.37
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HPGD P15428 1/20 0.37
PRMT5 O14744 1/20 0.36
WDR77 Q9BQA1 1/20 0.36
GUSB P08236 1/20 0.35
HRH3 Q9Y5N1 2/20 0.35
GRM2 Q14416 1/20 0.34
FFAR1 O14842 3/20 0.33
KIF11 P52732 1/20 0.32
SLC6A2 P23975 1/20 0.32
SLC6A4 P31645 1/20 0.32
SLC6A3 Q01959 1/20 0.32
LTA4H P09960 1/20 0.32

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
SCHEMBL17469146 0.92 DRD3 (0.40) HTR2CDRD3HRH3FFAR1KIF11
SCHEMBL17469070 0.90 GUSB (0.41) KDM4EALDH1A1HPGDGUSBSLC6A2
SCHEMBL17459409 0.86 SLC6A2 (0.40) GUSBSLC6A2SLC6A4SLC6A3LTA4H
SCHEMBL17459309 0.84 LTA4H (0.40) KDM4EHRH3SLC6A2SLC6A4SLC6A3
SCHEMBL17469027 0.81 MAOB (0.42) DRD3KDM4EALDH1A1HPGDKIF11
SCHEMBL17468345 0.81 MAOB (0.42) DRD3KDM4EALDH1A1HPGDKIF11
SCHEMBL17469111 0.81 DRD3 (0.40) HTR2CDRD3HRH3FFAR1KIF11
SCHEMBL17469148 0.80 KDM1A (0.42) ALDH1A1PRMT5WDR77
SCHEMBL17459422 0.79 LMNA (0.48) DRD3SLC6A2SLC6A4SLC6A3
SCHEMBL17469139 0.78 MAOB (0.43) SLC6A2SLC6A4SLC6A3LTA4H

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