SCHEMBL7468313

SCHEMBL7468313

Cn1c(C(F)(F)F)cc(=O)n(-c2ccc3onc(OCC(=O)O)c3c2)c1=O

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.39
AGER Q15109 1/20 0.34
LPAR5 Q9H1C0 1/20 0.32
F10 P00742 7/20 0.32
F2 P00734 6/20 0.32
POLB P06746 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
ALDH1A1 P00352 2/20 0.31
FAAH O00519 1/20 0.31
KDM4E B2RXH2 1/20 0.31
HPGD P15428 1/20 0.31
S1PR1 P21453 1/20 0.31
MAPT P10636 1/20 0.31
PPARD Q03181 1/20 0.31
PPARA Q07869 1/20 0.31
LMNA P02545 1/20 0.31
NR4A1 P22736 1/20 0.31
APEX1 P27695 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
SCHEMBL7468314 0.90 POLB (0.35) PKMF10F2POLBMEN1
SCHEMBL7459811 0.86 LPAR5 (0.34) LPAR5F10F2FAAH
SCHEMBL7462485 0.84 MAPT (0.35) PKMPOLBMEN1KMT2AALDH1A1
SCHEMBL7465907 0.83 KDM4E (0.39) PKMAGERPOLBMEN1KMT2A
SCHEMBL7462493 0.83 KDM4E (0.39) PKMAGERPOLBMEN1KMT2A
SCHEMBL7465900 0.83 PTGDR2 (0.39) PKMKDM4EMAPTPPARDPPARA
SCHEMBL7469056 0.82 LPAR5 (0.30) LPAR5
SCHEMBL7453836 0.81 PKM (0.39) PKMAGERPOLBALDH1A1PPARD
SCHEMBL7459329 0.80 HSP90AA1 (0.33) LPAR5F10F2LMNA
SCHEMBL7466745 0.80 BRD9 (0.36) LPAR5F10F2MEN1KMT2A

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