SCHEMBL17469122

SCHEMBL17469122

CCN1Cc2ccccc2OC(c2ccc(S(C)(=O)=O)cc2)C1

nearest known ligand 0.40

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 4/20 0.38
GHSR Q92847 1/20 0.36
PTGS2 P35354 1/20 0.36
KDM2B Q8NHM5 1/20 0.35
NAMPT P43490 1/20 0.35
HRH3 Q9Y5N1 1/20 0.35
MAOB P27338 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
SCHEMBL17469027 0.85 MAOB (0.42) LTA4HMAOB
SCHEMBL17468345 0.85 MAOB (0.42) LTA4HMAOB
SCHEMBL17459277 0.83 LTA4H (0.38) LTA4HMAOB
SCHEMBL17459409 0.83 SLC6A2 (0.40) LTA4H
SCHEMBL17459287 0.83 LTA4H (0.38) LTA4HMAOB
SCHEMBL17459303 0.83 LTA4H (0.38) LTA4HMAOB
SCHEMBL17459309 0.83 LTA4H (0.40) LTA4HHRH3MAOB
SCHEMBL17468786 0.81 LTA4H (0.41) LTA4H
SCHEMBL17469000 0.81 MAOB (0.50) LTA4HHRH3MAOB
SCHEMBL17459470 0.81 LTA4H (0.40) 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