SCHEMBL5134852

SCHEMBL5134852

Cc1cc(-c2ccc(C)c(-c3ccc(NC(=O)c4cccc(F)c4F)cn3)c2)on1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.46
IDO1 P14902 5/20 0.44
ABL1 P00519 2/20 0.43
DCLK1 O15075 1/20 0.43
DYRK3 O43781 1/20 0.43
ROCK2 O75116 1/20 0.43
PRKD3 O94806 1/20 0.43
MAP4K4 O95819 1/20 0.43
EGFR P00533 1/20 0.43
NTRK1 P04629 1/20 0.43
LCK P06239 1/20 0.43
FYN P06241 1/20 0.43
CDK1 P06493 1/20 0.43
CSF1R P07333 1/20 0.43
LYN P07948 1/20 0.43
SRC P12931 1/20 0.43
MARK3 P27448 1/20 0.43
AXL P30530 1/20 0.43
FLT4 P35916 1/20 0.43
FLT3 P36888 1/20 0.43

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
SCHEMBL2813829 0.90 IL2 (0.51) KMT2AIL2MAPTMEN1MAPK1
SCHEMBL4769856 0.78 IL2 (0.62) KMT2AGLAIL2MAPTMEN1
SCHEMBL2811967 0.78 IL2 (0.52) IL2
SCHEMBL2814669 0.75 IL2 (0.52) ALDH1A1IL2MAPK1
SCHEMBL9964636 0.75 STIM1 (0.53) KMT2AALDH1A1GLASMN1; SMN2IL2
Hydrochloric Acid SCHEMBL2812954 0.75 IL2 (0.51) ALDH1A1IL2MAPK1
SCHEMBL2815706 0.74 IL2 (0.64) ABL1IL2
SCHEMBL2814392 0.72 IL2 (0.51) ABL1DYRK3PRKD3MAP4K4EGFR
SCHEMBL2814289 0.72 IL2 (0.49) ABL1DYRK3PRKD3MAP4K4EGFR
SCHEMBL2812970 0.72 IL2 (0.66) IL2

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-1984338-A2 PYRIDYLPHENYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES Synta Pharmaceuticals Corporation (US) 2008-10-29 EP disclosed
WO-2007089904-A2 PYRIDYLPHENYL COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2007-08-09 WO disclosed