SCHEMBL24678884

SCHEMBL24678884

Cn1c(-c2ccccn2)cc2cnc3[nH]ccc3c21

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
PRKCI P41743 1/20 0.47
TGFBR1 P36897 3/20 0.41
TGFBR2 P37173 3/20 0.41
JAK2 O60674 13/20 0.41
AXL P30530 1/20 0.40
JAK3 P52333 6/20 0.39
JAK1 P23458 6/20 0.39
RET P07949 1/20 0.38
FGFR1 P11362 1/20 0.38
LTK P29376 1/20 0.38
GRK5 P34947 1/20 0.38
BTK Q06187 1/20 0.38
MAP4K2 Q12851 1/20 0.38
STK33 Q9BYT3 1/20 0.38
TYK2 P29597 1/20 0.37
PARP1 P09874 1/20 0.36

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
SCHEMBL30105765 0.79 JAK1 (0.54) JAK2JAK3JAK1TYK2
SCHEMBL24678767 0.79 JAK1 (0.54) JAK2JAK3JAK1TYK2
SCHEMBL28921687 0.79 JAK2 (0.53) JAK2JAK3JAK1TYK2
SCHEMBL28613682 0.79 JAK2 (0.53) JAK2JAK3JAK1TYK2
SCHEMBL30084315 0.76 JAK2 (0.58) PRKCIJAK2JAK3JAK1TYK2
SCHEMBL24678168 0.76 JAK2 (0.58) PRKCIJAK2JAK3JAK1TYK2
SCHEMBL24678443 0.76 JAK2 (0.58) PRKCIJAK2JAK3JAK1TYK2
SCHEMBL30084313 0.76 JAK2 (0.58) PRKCIJAK2JAK3JAK1TYK2
SCHEMBL28898689 0.76 JAK2 (0.58) PRKCIJAK2JAK3JAK1TYK2
SCHEMBL30084204 0.76 JAK2 (0.58) PRKCIJAK2JAK3JAK1TYK2

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-2022247676-A1 COMPOUND WITH DIPYRROLOPYRIDINE STRUCTURE, AND PREPARATION METHOD THEREFOR AND MEDICAL USE THEREOF 南京康屹生物医药中心(有限合伙) 2022-12-01 WO disclosed