SCHEMBL625490

SCHEMBL625490

FC(F)(F)Oc1cccc(-c2cn3nc(NC4CC5(CCN(CC6CC6)CC5)C4)sc3n2)c1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 17/20 0.39
PIM3 Q86V86 3/20 0.37
F2RL3 Q96RI0 2/20 0.36
KCNH2 Q12809 4/20 0.36
PIM2 Q9P1W9 4/20 0.36
FLT3 P36888 3/20 0.36
GAK O14976 1/20 0.36
STK10 O94804 1/20 0.36
YES1 P07947 1/20 0.36
RET P07949 1/20 0.36
PDGFRB P09619 1/20 0.36
CSNK2A2 P19784 1/20 0.36
ACVR1 Q04771 1/20 0.36
PKN1 Q16512 1/20 0.36
HASPIN Q8TF76 1/20 0.36
SIK2 Q9H0K1 1/20 0.36
SLK Q9H2G2 1/20 0.36
BMP2K Q9NSY1 1/20 0.36
PRKAG2 Q9UGJ0 1/20 0.36
RPS6KA6 Q9UK32 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
SCHEMBL623722 0.87 PIM1 (0.43) PIM1PIM3F2RL3KCNH2PIM2
SCHEMBL625561 0.86 PIM1 (0.49) PIM1PIM3F2RL3KCNH2PIM2
SCHEMBL625296 0.85 F2RL3 (0.38) PIM1PIM3F2RL3KCNH2PIM2
SCHEMBL625489 0.84 PIM1 (0.49) PIM1PIM3KCNH2PIM2FLT3
SCHEMBL625496 0.83 PIM1 (0.39) PIM1PIM3F2RL3KCNH2
SCHEMBL1945312 0.81 FYN (0.45) PIM1F2RL3KCNH2PIM2FLT3
SCHEMBL623435 0.80 PIM1 (0.46) PIM1PIM3F2RL3KCNH2PIM2
SCHEMBL1944061 0.80 PIM1 (0.54) PIM1PIM3F2RL3KCNH2PIM2
SCHEMBL625292 0.79 PIM1 (0.53) PIM1PIM3F2RL3KCNH2PIM2
SCHEMBL626259 0.79 PIM1 (0.53) PIM1F2RL3KCNH2PIM2FLT3

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