SCHEMBL17469138

SCHEMBL17469138

CCN1Cc2ccccc2OC(c2ccc(-c3ccc(C(F)(F)F)cc3)cc2)C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.36
DRD3 P35462 8/20 0.36
CSF1R P07333 2/20 0.35
KIF11 P52732 1/20 0.35
SIRT2 Q8IXJ6 1/20 0.34
SIRT1 Q96EB6 1/20 0.34
LTA4H P09960 1/20 0.34
CHKA P35790 1/20 0.34
PRMT5 O14744 1/20 0.34
WDR77 Q9BQA1 1/20 0.34
CHRM1 P11229 1/20 0.33
KCNH2 Q12809 1/20 0.33

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
SCHEMBL17469148 0.91 KDM1A (0.42) PRMT5WDR77KCNH2
SCHEMBL17459309 0.88 LTA4H (0.40) LTA4H
SCHEMBL17469139 0.87 MAOB (0.43) LTA4H
SCHEMBL17469070 0.85 GUSB (0.41) LTA4H
SCHEMBL17469165 0.83 MAOB (0.47) LTA4H
SCHEMBL17469027 0.83 MAOB (0.42) DRD3KIF11LTA4H
SCHEMBL17468345 0.83 MAOB (0.42) DRD3KIF11LTA4H
SCHEMBL17469152 0.82 SLC6A2 (0.35) LTA4H
SCHEMBL17469144 0.82 LTA4H (0.34) DRD2LTA4H
SCHEMBL17459303 0.81 LTA4H (0.38) LTA4H

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