SCHEMBL4849288

SCHEMBL4849288

Brc1cn(CCc2cccs2)c2cnccc12

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
DYRK1A Q13627 9/20 0.41
NFATC1 O95644 4/20 0.41
GSK3B P49841 4/20 0.41
CNR2 P34972 2/20 0.41
CNR1 P21554 1/20 0.41
KCNH2 Q12809 3/20 0.37
PLA2G7 Q13093 2/20 0.36
KDM4C Q9H3R0 2/20 0.34
CNOT7 Q9UIV1 1/20 0.34
TAAR1 Q96RJ0 1/20 0.34
HPGD P15428 1/20 0.34
HTT P42858 1/20 0.34
HRH3 Q9Y5N1 1/20 0.33

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
SCHEMBL4856807 0.75 CNR1 (0.44) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL4858180 0.75 DYRK1A (0.46) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL32691572 0.74 DYRK1A (0.67) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL21917167 0.74 DYRK1A (0.67) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL4855827 0.74 DYRK1A (0.47) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL4855991 0.74 DYRK1A (0.51) DYRK1ANFATC1GSK3BKCNH2KDM4C
SCHEMBL4853249 0.73 DYRK1A (0.41) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL21917355 0.72 DYRK1A (0.44) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL4852904 0.72 CNR2 (0.48) DYRK1ANFATC1GSK3BCNR2CNR1
SCHEMBL4849562 0.72 DYRK1A (0.38) DYRK1ANFATC1GSK3BCNR2KCNH2

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
US-7456169-B2 Heterocyclic kinase inhibitors ABBOTT LABORATORIES INC. (US) 2008-11-25 US disclosed
US-20070254867-A1 Heterocyclic Kinase Inhibitors ABBVIE INC. 2007-11-01 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070254867-A1 Heterocyclic Kinase Inhibitors MAP3K20, MAP3K19, MAP4K2 DYRK1A 1117/4885NFATC1 1618/4885GSK3B 465/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.