SCHEMBL2861567

SCHEMBL2861567

CS(=O)(=O)c1cccc(NC(=O)Oc2cnn(-c3ccccn3)c2C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MALT1 Q9UDY8 3/20 0.41
SMN1; SMN2 Q16637 2/20 0.40
MAPK1 P28482 1/20 0.40
JAK1 P23458 1/20 0.40
TYK2 P29597 1/20 0.40
ALDH1A1 P00352 2/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
SLC11A2 P49281 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
LMNA P02545 3/20 0.39
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
KDM4E B2RXH2 1/20 0.39
HSP90AA1 P07900 1/20 0.39
MAPT P10636 1/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ATM Q13315 1/20 0.38
RXFP1 Q9HBX9 3/20 0.38
SYK P43405 1/20 0.38

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
SCHEMBL2854592 0.90 MEN1 (0.40) MALT1SMN1; SMN2JAK1TYK2ALDH1A1
SCHEMBL2854463 0.89 CA12 (0.44) SMN1; SMN2MAPK1L3MBTL1LMNAMEN1
SCHEMBL2862993 0.88 MEN1 (0.41) MALT1SMN1; SMN2ALDH1A1KEAP1NFE2L2
SCHEMBL2862974 0.87 KEAP1 (0.50) SMN1; SMN2ALDH1A1KEAP1NFE2L2LMNA
SCHEMBL2854810 0.86 KMT2A (0.46) MALT1ALDH1A1SLC11A2L3MBTL1LMNA
SCHEMBL2857895 0.85 GRM4 (0.48) MALT1SMN1; SMN2MAPK1ALDH1A1SLC11A2
SCHEMBL2857601 0.85 LMNA (0.37) MALT1ALDH1A1KEAP1NFE2L2LMNA
SCHEMBL2856385 0.84 CCR1 (0.44) KEAP1NFE2L2LMNARXFP1CA1
SCHEMBL2856588 0.83 KEAP1 (0.42) SMN1; SMN2MAPK1ALDH1A1KEAP1NFE2L2
SCHEMBL2855798 0.83 MAPT (0.45) SMN1; SMN2ALDH1A1KEAP1NFE2L2LMNA

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