SCHEMBL14730544

SCHEMBL14730544

CC(=O)N(N)c1nc(OS(=O)(=O)c2ccccc2)ncc1F

nearest known ligand 0.34

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
METAP2 P50579 1/20 0.34
METAP1 P53582 1/20 0.34
KMT2A Q03164 4/20 0.33
LMNA P02545 2/20 0.32
MAPT P10636 2/20 0.32
TDP1 Q9NUW8 2/20 0.31
KEAP1 Q14145 4/20 0.31
NFE2L2 Q16236 4/20 0.31
ALDH1A1 P00352 3/20 0.30
KDM4E B2RXH2 2/20 0.30
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30
NPSR1 Q6W5P4 1/20 0.30
ENPP3 O14638 1/20 0.30
ENPP1 P22413 1/20 0.30
ENPP2 Q13822 1/20 0.30
HTT P42858 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
SCHEMBL3168148 0.76 ALDH1A1 (0.41) METAP2METAP1KMT2ALMNAMAPT
SCHEMBL3182595 0.76 METAP2 (0.40) METAP2METAP1KMT2AMAPTTDP1
SCHEMBL3173557 0.70 RAB9A (0.38) METAP2METAP1KMT2ALMNAMAPT
SCHEMBL3173555 0.70 RAB9A (0.38) METAP2METAP1KMT2ALMNAMAPT
SCHEMBL13530344 0.68 MAPK14 (0.39) METAP2METAP1LMNATDP1ALDH1A1
SCHEMBL14730588 0.67 METAP2 (0.35) METAP2METAP1MAPTTDP1ALDH1A1
SCHEMBL13530376 0.66 P2RY12 (0.43) KMT2ALMNAKEAP1NFE2L2ALDH1A1
SCHEMBL13530363 0.64 HTT (0.45) LMNATDP1NFE2L2HTT
SCHEMBL13530302 0.64 TDP1 (0.39) KMT2AMAPTTDP1NFE2L2KDM4E
SCHEMBL27651022 0.63 METAP2 (0.43) METAP2METAP1KMT2AMAPTTDP1

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2562161-A1 5-FLUORO PYRIMIDINE DERIVATIVES AS FUNGICIDES Dow AgroSciences LLC (US) 2013-02-27 EP disclosed