SCHEMBL28610641

SCHEMBL28610641

C=CC(=O)N1CCC[C@H](Nc2nc(Cl)nc3[nH]cc(C)c23)C1

nearest known ligand 0.72

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
JAK3 P52333 20/20 0.72
BTK Q06187 13/20 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
SCHEMBL22496744 1.00 JAK3 (0.72) JAK3BTK
SCHEMBL22496747 1.00 JAK3 (0.72) JAK3BTK
SCHEMBL22497081 0.90 JAK3 (0.75) JAK3BTK
SCHEMBL22497078 0.90 JAK3 (0.75) JAK3BTK
SCHEMBL28918248 0.89 JAK3 (0.56) JAK3BTK
SCHEMBL28918249 0.89 JAK3 (0.56) JAK3BTK
SCHEMBL22496698 0.86 JAK3 (0.74) JAK3BTK
SCHEMBL22496697 0.86 JAK3 (0.74) JAK3BTK
SCHEMBL16764589 0.84 JAK3 (1.00) JAK3
SCHEMBL16764591 0.84 JAK3 (1.00) JAK3

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
CN-109311896-B Pyrazolopyrimidine derivatives as kinase inhibitors 株式会社大熊制药 2021-08-24 CN disclosed
CN-113135920-A Pyrazolopyrimidine derivatives as kinase inhibitors 株式会社大熊制药 2021-07-20 CN disclosed