SCHEMBL25929685

SCHEMBL25929685

CCN1CCC(n2cc(-c3cn(S(=O)(=O)c4ccccc4)c4ncc(-c5cnc(N6CCC(F)(F)CC6)c(C)c5)nc34)cn2)CC1

nearest known ligand 0.34

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MET P08581 1/20 0.34
KHK P50053 1/20 0.34
EGFR P00533 2/20 0.34
AXL P30530 2/20 0.33
MERTK Q12866 2/20 0.33
GSK3B P49841 2/20 0.32
DYRK1A Q13627 2/20 0.32
MAP4K1 Q92918 1/20 0.32
JAK2 O60674 1/20 0.32
ABL1 P00519 1/20 0.32
JAK1 P23458 1/20 0.32
TYK2 P29597 1/20 0.32
JAK3 P52333 1/20 0.32
FGFR1 P11362 2/20 0.32
FGFR2 P21802 1/20 0.32
FGFR3 P22607 1/20 0.32
BRD4 O60885 1/20 0.32
MAP3K7 O43318 1/20 0.31
TAB1 Q15750 1/20 0.31
PIK3CA P42336 1/20 0.31

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
SCHEMBL25927872 0.91 JAK2 (0.38) METKHKEGFRAXLMERTK
SCHEMBL25930865 0.88 MET (0.36) METKHKEGFRAXLMERTK
SCHEMBL25929941 0.87 FFAR2 (0.34) METKHKEGFRAXLMERTK
SCHEMBL25931287 0.85 JAK2 (0.42) METKHKEGFRAXLMERTK
SCHEMBL25929255 0.85 EGFR (0.36) METKHKEGFRAXLMERTK
SCHEMBL25927780 0.84 JAK2 (0.37) METKHKEGFRAXLMERTK
SCHEMBL25929408 0.84 JAK2 (0.36) METKHKEGFRAXLMERTK
SCHEMBL25929553 0.83 BRD4 (0.36) METKHKEGFRAXLMERTK
SCHEMBL25931674 0.83 EGFR (0.41) METEGFRAXLMERTKMAP4K1
SCHEMBL25930792 0.83 AXL (0.39) METEGFRAXLMERTKGSK3B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023131271-A1 PYRROLE FUSED-RING PYRAZOLE COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF 杭州中美华东制药有限公司 2023-07-13 WO disclosed