SCHEMBL19987076

SCHEMBL19987076

FNc1ccc2ncc(-c3cccc(C(F)(F)F)c3)n2n1

nearest known ligand 0.71

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 5/20 0.71
DYRK2 Q92630 5/20 0.71
FYN P06241 4/20 0.71
CCNA2 P20248 4/20 0.70
CDK2 P24941 4/20 0.70
CDK5 Q00535 4/20 0.70
CDK5R1 Q15078 4/20 0.70
DYRK1B Q9Y463 4/20 0.70
PIM1 P11309 10/20 0.68
KCNH2 Q12809 2/20 0.68
CCNT1 O60563 3/20 0.67
CDK9 P50750 3/20 0.67
DYRK3 O43781 2/20 0.65
PIM3 Q86V86 1/20 0.63
PIM2 Q9P1W9 1/20 0.63
MKNK1 Q9BUB5 1/20 0.54
LRRK2 Q5S007 1/20 0.49

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
SCHEMBL29781258 0.89 FYN (0.70) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL102751 0.83 DYRK1A (0.76) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL2945964 0.83 FYN (1.00) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL24736875 0.83 PIM1 (0.61) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL14898077 0.82 FYN (0.61) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL24736843 0.82 PIM1 (0.83) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL19987067 0.82 PIM1 (0.83) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL24737157 0.82 FYN (0.94) DYRK1ADYRK2FYNCCNA2CDK2
SCHEMBL137404 0.82 PIM1 (0.84) FYNPIM1KCNH2PIM3PIM2
SCHEMBL19987123 0.82 DYRK3 (0.69) DYRK1ADYRK2FYNCCNA2CDK2

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
EP-2734205-B1 HETEROCYCLIC PROTEIN KINASE INHIBITORS TOLERO PHARMACEUTICALS INC (US) 2018-03-21 EP disclosed