SCHEMBL2713245

SCHEMBL2713245

CCC(C)N(N)c1nc(Nc2ccc3ncsc3c2)c(C(N)=O)cc1F

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
SYK P43405 8/20 0.54
IRAK4 Q9NWZ3 12/20 0.47
JAK3 P52333 2/20 0.47

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
SCHEMBL2715827 0.91 SYK (0.52) SYKIRAK4JAK3
SCHEMBL2715833 0.91 SYK (0.52) SYKIRAK4JAK3
SCHEMBL2713314 0.84 SYK (0.52) SYKIRAK4JAK3
SCHEMBL2713311 0.84 SYK (0.52) SYKIRAK4JAK3
SCHEMBL2713347 0.83 SYK (0.56) SYKIRAK4
SCHEMBL2714504 0.82 SYK (0.54) SYKIRAK4JAK3
SCHEMBL2714500 0.82 SYK (0.54) SYKIRAK4JAK3
SCHEMBL14909203 0.81 SYK (0.55) SYKIRAK4JAK3
SCHEMBL2714670 0.80 SYK (0.63) SYKIRAK4JAK3
SCHEMBL2714680 0.80 SYK (0.63) SYKIRAK4JAK3

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-2635556-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS Portola Pharmaceuticals, Inc. (US) 2013-09-11 EP disclosed
WO-2012061418-A2 BENZAMIDES AND NICOTINAMIDES AS SYK MODULATORS PORTOLA PHARMACEUTICALS, INC. (US) 2012-05-10 WO disclosed