SCHEMBL8260573

SCHEMBL8260573

C#Cc1nc(-c2ccccc2)c(NC(=O)NS(=O)(=O)c2ccc(Cl)cc2)s1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 2/20 0.47
KDM4E B2RXH2 2/20 0.47
PTGS1 P23219 2/20 0.44
PTGS2 P35354 2/20 0.44
NTRK1 P04629 1/20 0.44
FLT1 P17948 3/20 0.43
FLT4 P35916 3/20 0.43
KDR P35968 3/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
GAA P10253 1/20 0.43
MAPT P10636 1/20 0.43
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
LMNA P02545 2/20 0.41
ALOX12 P18054 1/20 0.41
HTT P42858 1/20 0.41
TASP1 Q9H6P5 1/20 0.41
PTGES O14684 2/20 0.40
ALOX5 P09917 2/20 0.40
CA12 O43570 1/20 0.40

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
SCHEMBL5815917 0.85 NTRK1 (0.65) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL8260616 0.82 KDM4E (0.48) CYP2C9KDM4EPTGS1PTGS2NTRK1
SCHEMBL8259565 0.82 KDM4E (0.48) CYP2C9KDM4EPTGS1PTGS2NTRK1
SCHEMBL8260918 0.81 KDM4E (0.45) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL5819740 0.80 KDM4E (0.43) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL5819206 0.80 ALDH1A1 (0.49) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL5819647 0.79 KDM4E (0.45) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL5819644 0.78 KDM4E (0.44) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL5804725 0.77 KDM4E (0.44) KDM4EPTGS1PTGS2NTRK1FLT1
SCHEMBL8261314 0.77 GAA (0.45) CYP2C9KDM4EPTGS1PTGS2NTRK1

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
WO-2006085815-A1 THIAZOLE DERIVATIVES, THEIR PROCESS FOR THEIR PREPARATION AND THEIR USE IN THERAPY ASTRAZENECA AB (SE) 2006-08-17 WO disclosed