SCHEMBL6557199

SCHEMBL6557199

Cc1ccc(NC2CCNC2)cc1F

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
AXL P30530 3/20 0.43
ITK Q08881 1/20 0.42
BRD4 O60885 4/20 0.42
ATAD2 Q6PL18 4/20 0.42
IDH2 P48735 1/20 0.39
HRH4 Q9H3N8 1/20 0.39
PRKCQ Q04759 1/20 0.38
HTR6 P50406 2/20 0.37
PTGS1 P23219 1/20 0.37
PTGS2 P35354 1/20 0.37
RAPGEF4 Q8WZA2 1/20 0.37
MAP4K1 Q92918 1/20 0.37

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
SCHEMBL6557194 1.00 AXL (0.43) AXLITKBRD4ATAD2IDH2
SCHEMBL6559230 0.88 AXL (0.43) AXLITKBRD4ATAD2IDH2
SCHEMBL6559451 0.87 KDM1A (0.47) AXLITKIDH2HRH4PRKCQ
SCHEMBL6559446 0.87 KDM1A (0.47) AXLITKIDH2HRH4PRKCQ
SCHEMBL14614704 0.86 AXL (0.45) AXLITKBRD4ATAD2PRKCQ
SCHEMBL21460340 0.86 AXL (0.45) AXLITKBRD4ATAD2PRKCQ
SCHEMBL21727343 0.79 PTGS1 (0.51) PTGS1PTGS2RAPGEF4
SCHEMBL21533591 0.79 BRD4 (0.45) AXLITKBRD4ATAD2PRKCQ
SCHEMBL5390131 0.79 PRKCQ (0.43) AXLITKBRD4ATAD2PRKCQ
Hydrochloric Acid SCHEMBL5382559 0.78 PRKCQ (0.42) AXLITKBRD4ATAD2PRKCQ

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-1392651-A1 HETEROCYCLIC UREAS, THEIR PREPARATION AND THEIR USE AS VANILLOID RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM PLC (GB) 2004-03-03 EP disclosed
WO-2002090326-A1 HETEROCYCLIC UREAS, THEIR PREPARATION AND THEIR USE AS VANILLOID RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM P.L.C. (GB) 2002-11-14 WO disclosed