SCHEMBL7007197

SCHEMBL7007197

CCOC(=O)C(=CNC1CC1)C(=O)c1cc(F)c(Cl)nc1Cl.CCOC=C(C(=O)OCC)C(=O)c1cc(F)c(Cl)nc1Cl

nearest known ligand 0.36

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.36
NFE2L2 Q16236 1/20 0.36
GAA P10253 3/20 0.33
NPSR1 Q6W5P4 2/20 0.33
MAPT P10636 3/20 0.32
MEN1 O00255 5/20 0.32
KMT2A Q03164 5/20 0.32
ACKR3 P25106 1/20 0.32
HPGD P15428 3/20 0.32
KDM4E B2RXH2 2/20 0.32
ALDH1A1 P00352 1/20 0.32
NPY1R P25929 1/20 0.32
NPY2R P49146 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31
DHODH Q02127 2/20 0.31
LMNA P02545 1/20 0.31
CYP1A2 P05177 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 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
SCHEMBL5256945 0.94 KEAP1 (0.40) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL10551035 0.94 KEAP1 (0.40) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL5256943 0.94 KEAP1 (0.40) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL29457327 0.88 KEAP1 (0.46) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL4458375 0.88 KEAP1 (0.46) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL29733883 0.88 KEAP1 (0.46) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL7172244 0.88 KEAP1 (0.46) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL7012803 0.88 KEAP1 (0.46) KEAP1NFE2L2GAANPSR1MAPT
SCHEMBL9775871 0.82 ATM (0.37) GAANPSR1MAPTMEN1KMT2A
SCHEMBL9775870 0.82 ATM (0.37) GAANPSR1MAPTMEN1KMT2A

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-1341781-A1 ANTIMICROBIAL QUINOLONES THE PROCTER & GAMBLE COMPANY (US) 2003-09-10 EP disclosed
WO-2002048138-A1 ANTIMICROBIAL QUINOLONES THE PROCTER & GAMBLE COMPANY (US) 2002-06-20 WO disclosed