SCHEMBL2854592

SCHEMBL2854592

CS(=O)(=O)c1cccc(NC(=O)Oc2cnn(-c3ncccn3)c2C(F)(F)F)c1

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 4/20 0.40
KMT2A Q03164 4/20 0.40
MAPT P10636 2/20 0.40
L3MBTL1 Q9Y468 2/20 0.40
KDM4E B2RXH2 1/20 0.40
HSP90AA1 P07900 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
MALT1 Q9UDY8 5/20 0.40
LMNA P02545 1/20 0.39
SYK P43405 1/20 0.39
KEAP1 Q14145 1/20 0.39
NFE2L2 Q16236 1/20 0.39
JAK1 P23458 1/20 0.38
TYK2 P29597 1/20 0.38
CARM1 Q86X55 1/20 0.38
RXFP1 Q9HBX9 3/20 0.37
ALDH1A1 P00352 2/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
ATM Q13315 1/20 0.36
EPHX2 P34913 1/20 0.36

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
SCHEMBL2861567 0.90 MALT1 (0.41) MEN1KMT2AMAPTL3MBTL1KDM4E
SCHEMBL2862974 0.88 KEAP1 (0.50) MEN1KMT2AMAPTKDM4ENPSR1
SCHEMBL2856385 0.86 CCR1 (0.44) LMNAKEAP1NFE2L2CARM1RXFP1
SCHEMBL2854463 0.85 CA12 (0.44) MEN1KMT2AMAPTL3MBTL1KDM4E
SCHEMBL2857337 0.85 KMT2A (0.43) MEN1KMT2AMAPTL3MBTL1KDM4E
SCHEMBL2856588 0.85 KEAP1 (0.42) MEN1KMT2AMAPTKDM4ELMNA
SCHEMBL2855716 0.85 KEAP1 (0.46) MAPTLMNAKEAP1NFE2L2CARM1
SCHEMBL2855798 0.85 MAPT (0.45) MEN1KMT2AMAPTNPSR1LMNA
SCHEMBL2855496 0.85 KDM4E (0.46) MEN1KMT2AMAPTL3MBTL1KDM4E
SCHEMBL2862993 0.84 MEN1 (0.41) MEN1KMT2AMAPTL3MBTL1KDM4E

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