SCHEMBL19635798

SCHEMBL19635798

N#CN1CC[C@@H](n2nc(-c3ccc(Oc4ccc(Cl)cn4)cc3)c3c(N)ncnc32)C1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.61
EGFR P00533 1/20 0.61
JAK3 P52333 3/20 0.54
JAK2 O60674 2/20 0.54
JAK1 P23458 1/20 0.53
NUDT14 O95848 1/20 0.53
NUDT5 Q9UKK9 1/20 0.53
BLK P51451 2/20 0.52
LCK P06239 1/20 0.51
LYN P07948 1/20 0.51
FGR P09769 1/20 0.51
FLT3 P36888 1/20 0.51
CSK P41240 1/20 0.51
ITK Q08881 1/20 0.51

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
SCHEMBL19635799 1.00 BTK (0.61) BTKEGFRJAK3JAK2JAK1
SCHEMBL19635793 1.00 BTK (0.61) BTKEGFRJAK3JAK2JAK1
SCHEMBL19635789 0.95 BTK (0.68) BTKEGFRJAK3JAK2BLK
SCHEMBL19636020 0.95 BTK (0.68) BTKEGFRJAK3JAK2BLK
SCHEMBL19635663 0.95 JAK2 (0.59) BTKEGFRJAK3JAK2JAK1
SCHEMBL19635667 0.93 BTK (0.56) BTKEGFRJAK3JAK2JAK1
SCHEMBL19636023 0.86 JAK2 (0.64) BTKEGFRJAK3JAK2LCK
SCHEMBL19635797 0.86 JAK2 (0.64) BTKEGFRJAK3JAK2LCK
SCHEMBL19635214 0.86 BTK (0.55) BTKEGFRJAK3NUDT14NUDT5
SCHEMBL19635213 0.86 BTK (0.55) BTKEGFRJAK3NUDT14NUDT5

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111153906-B Pyrazolopyrimidine derivatives as BTK inhibitors, process for their preparation and pharmaceutical compositions containing them 苏州信诺维医药科技有限公司 2020-09-11 CN disclosed
CN-111153906-A Pyrazolopyrimidine derivatives as BTK inhibitors, process for their preparation and pharmaceutical compositions containing them 苏州信诺维医药科技有限公司 2020-05-15 CN disclosed
CN-107383013-B Pyrazolopyrimidine derivatives as BTK inhibitors, process for their preparation and pharmaceutical compositions containing them 苏州信诺维医药科技有限公司 2020-03-31 CN disclosed
WO-2017198049-A1 PYRAZOLOPYRIMIDINE DERIVATIVE AS BTK INHIBITOR AND PREPARATION METHOD AND PHARMACEUTICAL COMPOSITION THEREOF 浙江予川医药科技有限公司 2017-11-23 WO disclosed