SCHEMBL9256550

SCHEMBL9256550

OCC1C(F)C1c1ccc(Cl)c(Cl)c1

nearest known ligand 0.45

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
SLC6A2 P23975 15/20 0.42
SLC6A4 P31645 15/20 0.42
SLC6A3 Q01959 11/20 0.42
KCNH2 Q12809 2/20 0.39
CYP2D6 P10635 1/20 0.36

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
SCHEMBL9580469 0.86 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL9430941 0.80 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3KCNH2CYP2D6
SCHEMBL24737326 0.77 SLC6A2 (0.43) SLC6A2SLC6A4SLC6A3
SCHEMBL9254767 0.75
SCHEMBL764313 0.66 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL9580445 0.66 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL3748763 0.66 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3
SCHEMBL3748761 0.66 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3
SCHEMBL4879272 0.66 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2
SCHEMBL3889184 0.66 SLC6A2 (0.49) SLC6A2SLC6A4SLC6A3KCNH2

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
US-5459149-A Penta-2,4-dienamides and use as pesticides ROUSSEL UCLAF (FR) 1995-10-17 US disclosed
US-5270343-A Penta-2,4-dienamides and use as pesticides ROUSSEL UCLAF (FR) 1993-12-14 US disclosed