SCHEMBL19635807

SCHEMBL19635807

N#CN1CCC[C@@H](n2nc(-c3ccc(Oc4ccc(F)cc4F)cc3)c3c(N)ncnc32)C1

nearest known ligand 0.67

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.67
EGFR P00533 3/20 0.67
SRC P12931 1/20 0.67
BMX P51813 1/20 0.67
NR4A3 Q92570 1/20 0.67
JAK2 O60674 1/20 0.58
JAK3 P52333 1/20 0.58

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
SCHEMBL19635808 1.00 BTK (0.67) BTKEGFRSRCBMXNR4A3
SCHEMBL19635191 0.85 BTK (0.54) BTKEGFRSRCBMXNR4A3
SCHEMBL19635788 0.85 BTK (0.68) BTKEGFRSRCBMXNR4A3
SCHEMBL19635217 0.85 BTK (0.68) BTKEGFRSRCBMXNR4A3
SCHEMBL19635218 0.85 BTK (0.68) BTKEGFRSRCBMXNR4A3
SCHEMBL17479775 0.85 BTK (0.74) BTKEGFRSRCBMXNR4A3
SCHEMBL19636023 0.84 JAK2 (0.64) BTKEGFRSRCJAK2JAK3
SCHEMBL19635797 0.84 JAK2 (0.64) BTKEGFRSRCJAK2JAK3
SCHEMBL18123577 0.82 BTK (0.76) BTKEGFRSRCJAK3
SCHEMBL19635792 0.82 BTK (0.74) BTKEGFRSRCJAK3

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