SCHEMBL17459277

SCHEMBL17459277

CCN1Cc2ccccc2OC(c2ccc(N)cc2)C1

nearest known ligand 0.44

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 14/20 0.38
SLC6A2 P23975 1/20 0.36
SLC6A4 P31645 1/20 0.36
SLC6A3 Q01959 1/20 0.36
MAOB P27338 1/20 0.35
TSHR P16473 1/20 0.34
KDM4E B2RXH2 1/20 0.34
GAA P10253 1/20 0.34
MAPT P10636 1/20 0.34
RAD52 P43351 1/20 0.34
GFER P55789 1/20 0.34
SMN1; SMN2 Q16637 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
SCHEMBL17468345 0.89 MAOB (0.42) LTA4HSLC6A2SLC6A4SLC6A3MAOB
SCHEMBL17469027 0.89 MAOB (0.42) LTA4HSLC6A2SLC6A4SLC6A3MAOB
SCHEMBL17459287 0.87 LTA4H (0.38) LTA4HSLC6A2SLC6A4SLC6A3MAOB
SCHEMBL17459303 0.87 LTA4H (0.38) LTA4HSLC6A2SLC6A4SLC6A3MAOB
SCHEMBL17459309 0.87 LTA4H (0.40) LTA4HSLC6A2SLC6A4SLC6A3MAOB
SCHEMBL17459409 0.87 SLC6A2 (0.40) LTA4HSLC6A2SLC6A4SLC6A3
SCHEMBL17459470 0.85 LTA4H (0.40) LTA4HSLC6A2SLC6A4SLC6A3KDM4E
SCHEMBL17469000 0.85 MAOB (0.50) LTA4HSLC6A4MAOBMAPT
SCHEMBL17459468 0.85 LTA4H (0.40) LTA4HSLC6A2SLC6A4SLC6A3
SCHEMBL17469164 0.85 LTA4H (0.43) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

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