SCHEMBL8263162

SCHEMBL8263162

CSC(=N)N(C)C(=N)c1ccc(C)c(-c2ccc(NC(=O)c3c(F)cncc3F)cc2)c1

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
IL2 P60568 9/20 0.43
ABL1 P00519 4/20 0.41
MAPK14 Q16539 5/20 0.38
KCNQ3 O43525 1/20 0.37
KCNQ2 O43526 1/20 0.37
KCNE1 P15382 1/20 0.37
KCNQ1 P51787 1/20 0.37
KCNQ5 Q9NR82 1/20 0.37
F10 P00742 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
SCHEMBL8263164 0.90 IL2 (0.51) IL2MAPK14F10
SCHEMBL4766180 0.80 IL2 (0.52) IL2ABL1MAPK14
SCHEMBL12093754 0.78 IL2 (0.53) IL2ABL1MAPK14KCNQ3KCNQ2
SCHEMBL8261670 0.76 ABL1 (0.50) IL2ABL1MAPK14
SCHEMBL8261669 0.75 IL2 (0.51) IL2MAPK14
SCHEMBL8261688 0.72 IL2 (0.57) IL2MAPK14F10
SCHEMBL4770091 0.72 IL2 (0.52) IL2
SCHEMBL16456568 0.72 STIM1 (0.49) IL2ABL1MAPK14
SCHEMBL4762886 0.71 IL2 (0.48) IL2ABL1MAPK14
SCHEMBL4762822 0.71 IL2 (0.60) IL2MAPK14

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-2006083477-A2 COMPOUNDS FOR INFLAMMATION AND IMMUNE-RELATED USES SYNTA PHARMACEUTICALS CORP. (US) 2006-08-10 WO disclosed