SCHEMBL625549

SCHEMBL625549

FC(F)(F)c1cccc(-c2cn3nc(NC4CC5(CCNCC5)C4)sc3n2)c1

nearest known ligand 0.51

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
F2RL3 Q96RI0 4/20 0.51
PIM1 P11309 9/20 0.46
FLT3 P36888 4/20 0.46
PIM3 Q86V86 3/20 0.46
PIM2 Q9P1W9 3/20 0.46
AURKA O14965 1/20 0.38
GSK3B P49841 1/20 0.38
MEN1 O00255 1/20 0.38
POLB P06746 1/20 0.38
KMT2A Q03164 1/20 0.38
KCNH2 Q12809 2/20 0.36
CSNK1A1 P48729 1/20 0.35
CSNK1D P48730 1/20 0.35
RPS6KA3 P51812 1/20 0.35
MAPKAPK2 P49137 1/20 0.35
LMNA P02545 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
SCHEMBL625561 0.87 PIM1 (0.49) F2RL3PIM1FLT3PIM3PIM2
SCHEMBL624979 0.85 ADORA2A (0.38) F2RL3PIM1
SCHEMBL625541 0.84 FYN (0.47) F2RL3AURKA
SCHEMBL623829 0.82 F2RL3 (0.48) F2RL3
SCHEMBL1945224 0.82 F2RL3 (0.57) F2RL3PIM1FLT3PIM2GSK3B
SCHEMBL625548 0.82 FYN (0.52) PIM1FLT3PIM3PIM2KCNH2
SCHEMBL2257235 0.81 F2RL3 (0.56) F2RL3PIM1FLT3PIM3PIM2
SCHEMBL626108 0.81 MAP3K12 (0.42)
SCHEMBL623883 0.78 F2RL3 (0.52) F2RL3PIM1FLT3PIM2AURKA
SCHEMBL624816 0.75 PIM1 (0.51) F2RL3PIM1FLT3PIM3PIM2

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-2012020217-A1 AMINO- IMIDAZOLOTHIADIAZOLES FOR USE AS PROTEIN OR LIPID KINASE INHIBITORS CENTRO NACIONAL DE INVESTIGACIONES ONCOLÓGICAS (CNIO) (ES) 2012-02-16 WO disclosed