SCHEMBL28409686

SCHEMBL28409686

Nc1ncnc2c1c(-c1ccc(Oc3ccccc3)cc1)nn2C1CCCN(CC(=O)O)C1

nearest known ligand 0.78

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BTK Q06187 20/20 0.78
EGFR P00533 4/20 0.71
TEC P42680 3/20 0.71
BMX P51813 3/20 0.71
LYN P07948 3/20 0.71
ITK Q08881 3/20 0.71
LCK P06239 3/20 0.71
TXK P42681 2/20 0.71
FGFR2 P21802 2/20 0.71
FLT3 P36888 2/20 0.71
BLK P51451 2/20 0.71
RIPK2 O43353 1/20 0.71
NR1I2 O75469 1/20 0.71
SLC22A3 O75751 1/20 0.71
LATS1 O95835 1/20 0.71
NUDT14 O95848 1/20 0.71
ABL1 P00519 1/20 0.71
ERBB2 P04626 1/20 0.71
FYN P06241 1/20 0.71
PGR P06401 1/20 0.71

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
SCHEMBL28409697 1.00 BTK (0.78) BTKEGFRTECBMXLYN
SCHEMBL28409758 1.00 BTK (0.78) BTKEGFRTECBMXLYN
SCHEMBL28685158 0.93 BTK (0.75) BTKEGFRTECBMXLYN
SCHEMBL19638836 0.93 BTK (0.78) BTKEGFRTECBMXLYN
SCHEMBL19638837 0.93 BTK (0.78) BTKEGFRTECBMXLYN
SCHEMBL30615731 0.93 BTK (0.78) BTKEGFRTECBMXLYN
SCHEMBL16075643 0.93 BTK (0.74) BTKEGFRTECBMXLYN
SCHEMBL28409293 0.92 BTK (0.73) BTKEGFRTECBMXLYN
SCHEMBL28409287 0.92 BTK (0.73) BTKEGFRTECBMXLYN
SCHEMBL28409359 0.92 BTK (0.73) BTKEGFRTECBMXLYN

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-111171035-B Preparation method and application of 4-phenoxyphenyl pyrazolopyrimidine amide derivative 山东大学 2021-03-30 CN claimed
CN-111171035-A Preparation method and application of 4-phenoxyphenyl pyrazolopyrimidine amide derivative 山东大学 2020-05-19 CN claimed
CN-111171035-B Preparation method and application of 4-phenoxyphenyl pyrazolopyrimidine amide derivative 山东大学 2021-03-30 CN disclosed
CN-111171035-A Preparation method and application of 4-phenoxyphenyl pyrazolopyrimidine amide derivative 山东大学 2020-05-19 CN disclosed