SCHEMBL2862993

SCHEMBL2862993

CS(=O)(=O)c1cccc(NC(=O)Oc2cnn(-c3cccc(Cl)n3)c2C(F)(F)F)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.41
KMT2A Q03164 3/20 0.41
MAPT P10636 3/20 0.41
ALDH1A1 P00352 2/20 0.39
LMNA P02545 2/20 0.38
SCN10A Q9Y5Y9 1/20 0.38
KEAP1 Q14145 2/20 0.37
NFE2L2 Q16236 2/20 0.37
NPSR1 Q6W5P4 2/20 0.37
KDM4E B2RXH2 1/20 0.37
HSP90AA1 P07900 1/20 0.37
L3MBTL1 Q9Y468 1/20 0.37
CARM1 Q86X55 1/20 0.36
NPC1 O15118 1/20 0.36
RXFP1 Q9HBX9 2/20 0.36
MALT1 Q9UDY8 2/20 0.36
SYK P43405 1/20 0.36
GPX4 P36969 1/20 0.35
USP7 Q93009 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35

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 0.88 MALT1 (0.41) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2855798 0.86 MAPT (0.45) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2854492 0.86 MAPT (0.42) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2857917 0.85 MAPT (0.42) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2862974 0.85 KEAP1 (0.50) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2857601 0.85 LMNA (0.37) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2854463 0.85 CA12 (0.44) MEN1KMT2AMAPTLMNASCN10A
SCHEMBL2854592 0.84 MEN1 (0.40) MEN1KMT2AMAPTALDH1A1LMNA
SCHEMBL2856385 0.84 CCR1 (0.44) LMNASCN10AKEAP1NFE2L2CARM1
SCHEMBL2855716 0.83 KEAP1 (0.46) MAPTALDH1A1LMNASCN10AKEAP1

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