SCHEMBL21949142

SCHEMBL21949142

Cn1c(=O)c(Nc2ccc(N3CCOCC3)cc2)nc2c(F)cc(/C(C=N)=C/N)cc21

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SYK P43405 2/20 0.40
FGFR1 P11362 1/20 0.39
SRC P12931 1/20 0.39
MAPT P10636 4/20 0.37
MAPK1 P28482 3/20 0.37
MAPKAPK5 Q8IW41 1/20 0.37
TP53 P04637 1/20 0.37
ZAP70 P43403 3/20 0.36
STAT6 P42226 2/20 0.36
KDM4E B2RXH2 1/20 0.36
ALDH1A1 P00352 1/20 0.36
ALOX15 P16050 1/20 0.36
ALOX12 P18054 1/20 0.36
TDP1 Q9NUW8 1/20 0.36
BTK Q06187 4/20 0.36
NPSR1 Q6W5P4 1/20 0.36
JAK3 P52333 1/20 0.36
JAK2 O60674 1/20 0.36
EGFR P00533 1/20 0.35
MAPK10 P53779 1/20 0.35

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
SCHEMBL21949393 0.89 ZAP70 (0.39) FGFR1SRCMAPTMAPK1TP53
SCHEMBL21949415 0.85 PYGM (0.43) FGFR1SRCMAPTMAPK1TP53
SCHEMBL21949454 0.83 IRAK4 (0.41) SYKFGFR1SRCMAPTMAPK1
SCHEMBL21949426 0.80 MAPK9 (0.41) MAPTZAP70KDM4EALDH1A1TDP1
SCHEMBL21949412 0.80 HTT (0.42) SYKALDH1A1BTKJAK3JAK2
SCHEMBL21949865 0.78 FGFR1 (0.44) FGFR1SRCMAPTMAPK1TP53
SCHEMBL21949405 0.78 PYGM (0.44) FGFR1SRCEGFR
SCHEMBL21949139 0.77 SYK (0.39) SYKSRCMAPTMAPK1MAPKAPK5
SCHEMBL21949135 0.76 PYGM (0.41) SYK
SCHEMBL21949125 0.75 PYGM (0.41) SYKMAPTMAPK10

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
EP-3640247-B1 SYK INHIBITOR AND USE METHOD THEREFOR CHIA TAI TIANQING PHARMACEUTICAL GROUP CO LTD (CN) 2022-01-12 EP disclosed
EP-3640247-A1 SYK INHIBITOR AND USE METHOD THEREFOR Chia Tai Tianqing Pharmaceutical Group Co., Ltd. (CN) 2020-04-22 EP disclosed