SCHEMBL20161747

SCHEMBL20161747

C=CC(=O)N1C[C@H]2CC[C@@H](C1)N2Cc1cc(Sc2cnc(NC(=O)c3ccsc3)s2)c(C)cc1OC

nearest known ligand 0.77

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 19/20 0.77
BTK Q06187 16/20 0.69
TXK P42681 14/20 0.66

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
SCHEMBL20161230 0.87 JAK3 (1.00) JAK3BTKTXK
SCHEMBL24467326 0.87 JAK3 (1.00) JAK3BTKTXK
SCHEMBL20161931 0.85 JAK3 (0.72) JAK3BTKTXK
SCHEMBL23366088 0.85 JAK3 (0.95) JAK3BTKTXK
SCHEMBL24467223 0.84 JAK3 (1.00) JAK3BTKTXK
SCHEMBL23366099 0.84 JAK3 (1.00) JAK3BTKTXK
SCHEMBL20161885 0.84 JAK3 (1.00) JAK3BTKTXK
SCHEMBL20161960 0.84 JAK3 (0.80) JAK3BTKTXK
SCHEMBL20161926 0.82 JAK3 (0.65) JAK3BTKTXK
SCHEMBL23365956 0.82 JAK3 (0.95) JAK3BTKTXK

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-2018089261-A2 COMPOUNDS AND METHODS FOR MODULATING INTERLEUKIN-2-INDUCIBLE T-CELL KINASE CORVUS PHARMACEUTICALS, INC. (US) 2018-05-17 WO disclosed