SCHEMBL19986928

SCHEMBL19986928

CNc1ccc2ncc(-c3cccc(Cl)c3)n2n1

nearest known ligand 0.74

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
FYN P06241 5/20 0.74
MKNK1 Q9BUB5 1/20 0.74
DYRK3 O43781 4/20 0.69
DYRK1A Q13627 4/20 0.69
DYRK2 Q92630 4/20 0.69
DYRK1B Q9Y463 4/20 0.69
CCNT1 O60563 3/20 0.69
CDK9 P50750 3/20 0.69
CDK5 Q00535 3/20 0.69
CDK5R1 Q15078 3/20 0.69
CCNA2 P20248 2/20 0.69
CDK2 P24941 2/20 0.69
PIM1 P11309 11/20 0.65
KCNH2 Q12809 1/20 0.65

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
SCHEMBL19987123 0.87 DYRK3 (0.69) FYNDYRK3DYRK1ADYRK2DYRK1B
SCHEMBL23299224 0.85 FYN (0.76) FYNMKNK1DYRK3DYRK1ADYRK2
SCHEMBL16010275 0.85 FYN (1.00) FYNMKNK1
SCHEMBL30521845 0.85 FYN (1.00) FYNMKNK1
SCHEMBL16009706 0.83 FYN (0.74) FYNMKNK1
SCHEMBL16009532 0.82 FYN (0.73) FYNMKNK1DYRK1APIM1
SCHEMBL102942 0.82 DYRK1A (1.00) FYNDYRK3DYRK1ADYRK2DYRK1B
SCHEMBL2946476 0.81 FYN (0.60) FYNMKNK1DYRK3DYRK1ADYRK2
SCHEMBL2943786 0.81 MKNK1 (0.76) FYNMKNK1DYRK3DYRK1ADYRK2
SCHEMBL29781258 0.81 FYN (0.70) FYNMKNK1DYRK3DYRK1ADYRK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3409278-B1 HETEROCYCLIC PROTEIN KINASE INHIBITORS TOLERO PHARMACEUTICALS INC (US) 2020-09-16 EP disclosed
EP-2734205-B1 HETEROCYCLIC PROTEIN KINASE INHIBITORS TOLERO PHARMACEUTICALS INC (US) 2018-03-21 EP disclosed