SCHEMBL1940451

SCHEMBL1940451

Cc1c(NS(=O)(=O)c2ccccc2Cl)cccc1C(=O)c1cn(C(C)C)c2ncnc(N)c12

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDGFRB P09619 1/20 0.50
EIF2AK3 Q9NZJ5 2/20 0.48
PDPK1 O15530 5/20 0.45
NTRK1 P04629 4/20 0.43
NTRK3 Q16288 2/20 0.43
NTRK2 Q16620 2/20 0.43
KCNH2 Q12809 2/20 0.43
RET P07949 5/20 0.43
LCK P06239 3/20 0.43
SRC P12931 2/20 0.43
AKT1 P31749 2/20 0.41
MTOR P42345 2/20 0.41
AURKA O14965 1/20 0.41
GSK3B P49841 1/20 0.41
MARK1 Q9P0L2 1/20 0.41
KDR P35968 2/20 0.41
TEK Q02763 1/20 0.41
CCR4 P51679 1/20 0.40
PIK3CD O00329 1/20 0.39
PIK3CA P42336 1/20 0.39

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
SCHEMBL1939957 0.92 PDGFRB (0.51) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1940570 0.91 PDGFRB (0.54) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1941746 0.86 PDGFRB (0.50) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1939679 0.86 PDGFRB (0.54) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1939925 0.86 PDGFRB (0.50) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1940057 0.85 PDGFRB (0.59) PDGFRBPDPK1NTRK1NTRK3NTRK2
SCHEMBL1939658 0.84 PDGFRB (0.51) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1941376 0.84 EIF2AK3 (0.51) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1940736 0.84 PDGFRB (0.67) PDGFRBEIF2AK3PDPK1NTRK1NTRK3
SCHEMBL1941939 0.83 PDGFRB (0.55) PDGFRBEIF2AK3PDPK1NTRK1NTRK3

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1578751-B1 PYRROLOPYRIMIDINE DERIVATIVES PFIZER PROD INC (US) 2011-06-15 EP disclosed
CN-1726218-A Pyrrolopyrimidine derivatives PFIZER PROD INC (US) 2006-01-25 CN disclosed