SCHEMBL7463162

SCHEMBL7463162

Cc1nsc2ccc(-n3c(=O)cc(C(F)(F)F)n(CC#N)c3=O)cc12

nearest known ligand 0.33

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
AR P10275 4/20 0.33
POLB P06746 1/20 0.32
PARG Q86W56 2/20 0.31
NPSR1 Q6W5P4 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
SCHEMBL7459650 0.90
SCHEMBL7462471 0.87 AR (0.35) AR
SCHEMBL7454559 0.84 RGS4 (0.33)
SCHEMBL7459459 0.84 LMNA (0.32)
SCHEMBL7462566 0.83 AR (0.40) AR
SCHEMBL6771354 0.82 TP53 (0.32)
SCHEMBL7458483 0.76 PDE2A (0.31)
SCHEMBL7467306 0.73
SCHEMBL7460016 0.72 AR (0.31) AR
SCHEMBL7458018 0.71 PIK3CD (0.34)

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-0908457-B1 3-(1,2-benzisothiazol- and isoxazol-5-Y1)-2,4(1H,3H)-pyrimidinedione or thione and 3-(1,2-benzisothiazol- and isoxazol-5-y1)-4(3H)-pyrimidinone or thione herbicidal agents BASF AG (DE) 2002-11-13 EP disclosed
EP-0908457-A1 3-(1,2-benzisothiazol- and isoxazol-5-Y1)-2,4(1H,3H)-pyrimidinedione or thione and 3-(1,2-benzisothiazol- and isoxazol-5-y1)-4(3H)-pyrimidinone or thione herbicidal agents American Cyanamid Company (US) 1999-04-14 EP disclosed