SCHEMBL16570396

SCHEMBL16570396

C[C@@H]1CN(c2ccc(Nc3ncc4ccn(Cc5ccccc5CCS(C)(=O)=O)c4n3)cc2)CCN1

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ STAT6 P42226 9/20 0.52
▸ WEE1 P30291 2/20 0.46
▸ FGFR4 P22455 3/20 0.44
▸ FGFR1 P11362 1/20 0.44
▸ FGFR2 P21802 1/20 0.44
▸ FGFR3 P22607 1/20 0.44
▸ ADRA2A P08913 1/20 0.44
▸ ADRA2B P18089 1/20 0.44
▸ ADRA2C P18825 1/20 0.44
▸ JAK2 O60674 4/20 0.43
▸ BRD4 O60885 4/20 0.43
▸ JAK3 P52333 3/20 0.42
▸ JAK1 P23458 2/20 0.42
▸ BRD2 P25440 2/20 0.42
▸ BRD3 Q15059 2/20 0.42
▸ BRDT Q58F21 2/20 0.42

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
SCHEMBL16571108 0.92 STAT6 (0.48) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL17958750 0.88 STAT6 (0.53) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16570040 0.88 STAT6 (0.53) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL17958809 0.87 STAT6 (0.51) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16580878 0.87 STAT6 (0.51) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16569916 0.86 STAT6 (0.51) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16580723 0.86 STAT6 (0.51) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16570999 0.86 STAT6 (0.51) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16571177 0.85 STAT6 (0.49) STAT6WEE1FGFR4FGFR1FGFR2
SCHEMBL16570362 0.85 STAT6 (0.49) STAT6WEE1FGFR4FGFR1FGFR2

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-2015038417-A1 COMPOUNDS FOR REGULATING FAK AND/OR SRC PATHWAYS ASANA BIOSCIENCES, LLC (US) 2015-03-19 — — WO claimed
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