SCHEMBL7460656

SCHEMBL7460656

CC(C)NC(=O)c1nsc2ccc(-n3c(=O)cc(C(F)(F)F)n(C)c3=O)cc12

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 1/20 0.35
MAPT P10636 2/20 0.35
KDM4E B2RXH2 3/20 0.33
NPSR1 Q6W5P4 1/20 0.32
MLYCD O95822 1/20 0.32
TP53 P04637 4/20 0.32
LMNA P02545 3/20 0.32
DYRK1A Q13627 2/20 0.31
RXFP1 Q9HBX9 1/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
ALDH1A1 P00352 1/20 0.31
HPGD P15428 1/20 0.31
CYP1A2 P05177 1/20 0.31
PDE4A P27815 1/20 0.30
MAPK14 Q16539 1/20 0.30
GSK3B P49841 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
SCHEMBL6770664 0.89 DGAT2 (0.32) TP53LMNA
SCHEMBL6772569 0.89 LMNA (0.30) TP53LMNA
SCHEMBL7455485 0.89 MAPT (0.32) MAPTTP53LMNASMN1; SMN2
SCHEMBL7457582 0.87
SCHEMBL7461755 0.87 MAPT (0.34) L3MBTL1MAPTKDM4ENPSR1TP53
SCHEMBL6776830 0.86 NOTUM (0.32) TP53ALDH1A1
SCHEMBL7454412 0.86 ATM (0.32)
SCHEMBL7459420 0.86
SCHEMBL6771135 0.85
SCHEMBL6767468 0.85

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 3 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
US-6156700-A 3-(1,2-Benzisothiazol- and isoxazol-5-yl)-2,4(1H,3H)-pyrimidinedione or thione and 3-(1,2-benzisothiazol- and isoxazol-5-yl)-4(3H)-pyrimidinone or thione herbicidal agents AMERICAN CYANMID COMPANY (US) 2000-12-05 US 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