SCHEMBL19635201

SCHEMBL19635201

CC#CC(=O)N1C[C@H](n2nc(-c3ccc(Oc4ccc(F)cc4F)cc3)c3c(N)ncnc32)CC[C@@H]1C

nearest known ligand 0.58

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BTK Q06187 18/20 0.58
EGFR P00533 7/20 0.58
LCK P06239 4/20 0.58
ITK Q08881 3/20 0.58
BLK P51451 1/20 0.48

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
SCHEMBL19635204 1.00 BTK (0.58) BTKEGFRLCKITKBLK
SCHEMBL19636026 1.00 BTK (0.58) BTKEGFRLCKITKBLK
SCHEMBL19635200 0.88 EGFR (0.63) BTKEGFRLCKITKBLK
SCHEMBL19635229 0.88 EGFR (0.63) BTKEGFRLCKITKBLK
SCHEMBL28374156 0.88 EGFR (0.63) BTKEGFRLCKITKBLK
SCHEMBL19635203 0.88 EGFR (0.63) BTKEGFRLCKITKBLK
SCHEMBL19635827 0.86 BTK (0.56) BTKEGFRLCKITKBLK
SCHEMBL19635791 0.86 BTK (0.56) BTKEGFRLCKITKBLK
SCHEMBL19635218 0.84 BTK (0.68) BTKEGFRLCKBLK
SCHEMBL19635788 0.84 BTK (0.68) BTKEGFRLCKBLK

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