SCHEMBL6142845

SCHEMBL6142845

O=C(Cl)OC1=C(C(F)(F)F)SCCO1

nearest known ligand 0.31

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CTNNB1 P35222 1/20 0.31
WNT3A P56704 1/20 0.31

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
SCHEMBL3767102 0.66 MAPK1 (0.32)
SCHEMBL5183059 0.60 KDM4E (0.31)
SCHEMBL3764121 0.60 MAPK1 (0.36) CTNNB1WNT3A
SCHEMBL3967541 0.55 MAPK1 (0.51)
SCHEMBL8930177 0.52
SCHEMBL2236279 0.52 KIF11 (0.59)
SCHEMBL7020822 0.51
SCHEMBL802245 0.51 MAPK1 (0.33)
SCHEMBL11488683 0.51 MAPK1 (0.40) CTNNB1WNT3A
SCHEMBL1438522 0.50 ALDH1A1 (0.32)

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
EP-1599460-A2 OXATHIIN CARBOXAMIDE Bayer CropScience Aktiengesellschaft (DE) 2005-11-30 EP disclosed
WO-2004072023-A2 OXATHIIN CARBOXAMIDE BAYER CROPSCIENCE AKTIENGESELLSCHAFT (DE) 2004-08-26 WO disclosed