SCHEMBL29600679

SCHEMBL29600679

COC(=O)c1ccc(F)c(-c2c(F)cccc2F)n1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPT P10636 2/20 0.47
PIM2 Q9P1W9 16/20 0.44
PIM1 P11309 15/20 0.42
PIM3 Q86V86 15/20 0.42
CYP1A2 P05177 2/20 0.41
GAA P10253 1/20 0.41
RECQL P46063 1/20 0.41
NPC1 O15118 1/20 0.41
TP53 P04637 1/20 0.41
CYP3A4 P08684 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
GSK3B P49841 1/20 0.41
PRKCQ Q04759 1/20 0.41
KCNH2 Q12809 1/20 0.41
PKN1 Q16512 1/20 0.41

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
SCHEMBL15872828 1.00 MAPT (0.47) MAPTPIM2PIM1PIM3CYP1A2
SCHEMBL319232 0.85 PIM1 (0.44) MAPTPIM2PIM1PIM3CYP1A2
SCHEMBL320424 0.85 PIM1 (0.43) MAPTPIM2PIM1PIM3CYP1A2
SCHEMBL18652605 0.84 MAPT (0.43) MAPTCYP1A2GAARECQLNPC1
SCHEMBL319311 0.84 PIM1 (0.46) MAPTPIM2PIM1PIM3CYP1A2
SCHEMBL1711596 0.84 PIM1 (0.44) MAPTPIM2PIM1PIM3
SCHEMBL29599827 0.82 PIM2 (0.46) MAPTPIM2PIM1PIM3
SCHEMBL320431 0.82 MAPT (0.37) MAPTPIM2PIM1PIM3
SCHEMBL15872950 0.82 PIM2 (0.46) MAPTPIM2PIM1PIM3
SCHEMBL15883642 0.82 PIM2 (0.44) PIM2PIM1PIM3GSK3BPRKCQ

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
CN-108715590-B Thiazolecarboxamide and picolinamide compounds useful as PIM kinase inhibitors 因赛特公司 2022-03-08 CN disclosed