SCHEMBL21135817

SCHEMBL21135817

C/C=N/Nc1nc(N2CCOCC2)c2cc(C(=O)NC3CCNCC3)sc2n1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIKFYVE Q9Y2I7 6/20 0.49
FLT3 P36888 2/20 0.39
PDE7A Q13946 8/20 0.38
DCLK1 O15075 1/20 0.36
PDPK1 O15530 1/20 0.36
PRKD3 O94806 1/20 0.36
MAP4K4 O95819 1/20 0.36
CHEK2 O96017 1/20 0.36
PIM1 P11309 1/20 0.36
MAPK1 P28482 1/20 0.36
AXL P30530 1/20 0.36
FLT4 P35916 1/20 0.36
MAPK9 P45984 1/20 0.36
CSNK1D P48730 1/20 0.36
IRAK1 P51617 1/20 0.36
RPS6KA3 P51812 1/20 0.36
PRKX P51817 1/20 0.36
NEK4 P51957 1/20 0.36
PRKAA1 Q13131 1/20 0.36
STK3 Q13188 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
SCHEMBL21135833 0.92 PIKFYVE (0.47) PIKFYVEPDE7ACNR2RAB9AKMT2A
SCHEMBL21135829 0.90 PIKFYVE (0.48) PIKFYVEPDE7AMAPK1CNR2
SCHEMBL21055003 0.86 PIKFYVE (0.68) PIKFYVEFLT3KMT2A
SCHEMBL30312402 0.86 PIKFYVE (0.68) PIKFYVEFLT3KMT2A
SCHEMBL30312479 0.82 PIKFYVE (0.71) PIKFYVEFLT3KMT2A
SCHEMBL21054976 0.82 PIKFYVE (0.71) PIKFYVEFLT3KMT2A
SCHEMBL30312425 0.80 PIKFYVE (0.68) PIKFYVEPDE7AKMT2A
SCHEMBL21053987 0.80 PIKFYVE (0.68) PIKFYVEPDE7AKMT2A
SCHEMBL21055859 0.80 PIKFYVE (0.68) PIKFYVEPDE7AKMT2A
SCHEMBL23272110 0.79 PIKFYVE (0.67) PIKFYVERAB9AKMT2A

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-2019113523-A1 COMPOUNDS AND THERAPEUTIC USES THEREOF BAJJI ASHOK (US) 2019-06-13 WO disclosed