SCHEMBL2859938

SCHEMBL2859938

CS(=O)(=O)Nc1cccc(NC(=O)Oc2cnn(-c3ccc(Cl)cc3)c2C(F)(F)F)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.45
PTGS2 P35354 3/20 0.43
MEN1 O00255 2/20 0.43
KMT2A Q03164 2/20 0.43
DHX9 Q08211 1/20 0.42
KEAP1 Q14145 1/20 0.42
NFE2L2 Q16236 1/20 0.42
NPSR1 Q6W5P4 2/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CCR1 P32246 1/20 0.38
KDM4E B2RXH2 1/20 0.37
HSP90AA1 P07900 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
NR3C1 P04150 1/20 0.37
AR P10275 1/20 0.37
BRAF P15056 1/20 0.37
NPC1 O15118 2/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.37
ALDH1A1 P00352 1/20 0.37
EGFR P00533 2/20 0.37

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
SCHEMBL2855798 0.89 MAPT (0.45) MAPTPTGS2MEN1KMT2AKEAP1
SCHEMBL2848615 0.89 MAPT (0.44) MAPTMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL2850258 0.88 MAPT (0.51) MAPTMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL2860656 0.87 MAPT (0.41) MAPTPTGS2MEN1KMT2AKEAP1
SCHEMBL2853385 0.87 MAPT (0.42) MAPTMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL2853258 0.87 NPY5R (0.45) MAPTMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL2852324 0.86 MAPT (0.40) MAPTMEN1KMT2AKEAP1NFE2L2
SCHEMBL2860939 0.86 LMNA (0.45) MAPTMEN1KMT2ANPSR1SMN1; SMN2
SCHEMBL2854221 0.86 MAPT (0.51) MAPTMEN1KMT2ANPSR1CCR1
SCHEMBL2854572 0.86 RAB9A (0.44) MAPTMEN1KMT2ANPSR1SMN1; SMN2

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-1451160-B1 PYRAZOLE-AMIDES FOR USE IN THE TREATMENT OF PAIN ICAGEN INC (US) 2010-01-13 EP claimed