SCHEMBL29968465

SCHEMBL29968465

FC(F)(F)Oc1ccnc(Nc2cc(N3CC4(CCNC4)C3)nc(-c3cccnc3)n2)c1

nearest known ligand 0.39

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 3/20 0.38
NPY5R Q15761 2/20 0.37
MAPKAPK2 P49137 7/20 0.37
ABL1 P00519 2/20 0.36
KIT P10721 1/20 0.35
DYRK1A Q13627 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
SCHEMBL23763099 1.00 PIM1 (0.38) PIM1NPY5RMAPKAPK2ABL1KIT
Hydrochloric Acid SCHEMBL29968224 0.99 PIM1 (0.38) PIM1NPY5RMAPKAPK2ABL1KIT
SCHEMBL29968473 0.95 MAPKAPK2 (0.38) PIM1NPY5RMAPKAPK2ABL1KIT
SCHEMBL23763045 0.95 MAPKAPK2 (0.38) PIM1NPY5RMAPKAPK2ABL1KIT
SCHEMBL29968477 0.95 PIM1 (0.42) PIM1NPY5RMAPKAPK2ABL1KIT
SCHEMBL23763376 0.95 PIM1 (0.42) PIM1NPY5RMAPKAPK2ABL1KIT
SCHEMBL23763007 0.91 NPY5R (0.37) PIM1NPY5RABL1KIT
SCHEMBL29969336 0.91 NPY5R (0.37) PIM1NPY5RABL1KIT
SCHEMBL23763037 0.90 ALDH1A1 (0.42) PIM1MAPKAPK2ABL1
SCHEMBL29967990 0.90 ALDH1A1 (0.42) PIM1MAPKAPK2ABL1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115151534-B Inhibitors of interleukin-1 receptor associated kinase (IRAK)/FMS-like receptor tyrosine kinase (FLT 3), pharmaceutical products thereof and methods of use thereof 南京药石科技股份有限公司 2024-02-06 CN claimed
CN-115151534-A Inhibitors of interleukin-1 receptor-related kinase (IRAK)/FMS-like receptor tyrosine kinase (FLT 3), pharmaceutical products thereof, and methods thereof 南京药石科技股份有限公司 2022-10-04 CN claimed
CN-115151534-B Inhibitors of interleukin-1 receptor associated kinase (IRAK)/FMS-like receptor tyrosine kinase (FLT 3), pharmaceutical products thereof and methods of use thereof 南京药石科技股份有限公司 2024-02-06 CN disclosed
CN-115151534-A Inhibitors of interleukin-1 receptor-related kinase (IRAK)/FMS-like receptor tyrosine kinase (FLT 3), pharmaceutical products thereof, and methods thereof 南京药石科技股份有限公司 2022-10-04 CN disclosed