SCHEMBL17469033

SCHEMBL17469033

CCN1Cc2ccccc2OC(c2ccc(I)s2)C1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TSHR P16473 1/20 0.30
SLC6A2 P23975 1/20 0.30
SLC6A4 P31645 1/20 0.30
SLC6A3 Q01959 1/20 0.30
NISCH Q9Y2I1 2/20 0.30
LTA4H P09960 1/20 0.30

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
SCHEMBL17459281 0.85 KDM4E (0.33) TSHRSLC6A2SLC6A4SLC6A3NISCH
SCHEMBL17459294 0.85 KDM4E (0.33) TSHRSLC6A2SLC6A4SLC6A3NISCH
SCHEMBL17459364 0.80 SLC6A2 (0.41) TSHRSLC6A2SLC6A4SLC6A3NISCH
SCHEMBL17459293 0.79 SLC6A4 (0.46) SLC6A2SLC6A4SLC6A3
SCHEMBL17459303 0.79 LTA4H (0.38) SLC6A2SLC6A4SLC6A3LTA4H
SCHEMBL17468345 0.78 MAOB (0.42) SLC6A2SLC6A4SLC6A3LTA4H
SCHEMBL17469027 0.78 MAOB (0.42) SLC6A2SLC6A4SLC6A3LTA4H
SCHEMBL17459339 0.77 SLC22A12 (0.34) TSHRSLC6A2SLC6A4SLC6A3
SCHEMBL17459288 0.75 SLC6A2 (0.34) TSHRSLC6A2SLC6A4SLC6A3NISCH
SCHEMBL17459359 0.74 CYP19A1 (0.34) TSHRSLC6A2SLC6A4SLC6A3LTA4H

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