SCHEMBL3036473

SCHEMBL3036473

c1cncc(Nc2ccc3ncc(-c4ccncc4)n3n2)c1

nearest known ligand 0.81

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 6/20 0.81
FYN P06241 10/20 0.57
KCNH2 Q12809 3/20 0.52
DYRK3 O43781 2/20 0.51
CCNT1 O60563 2/20 0.51
CCNA2 P20248 2/20 0.51
CDK2 P24941 2/20 0.51
CDK9 P50750 2/20 0.51
CDK5 Q00535 2/20 0.51
DYRK1A Q13627 2/20 0.51
CDK5R1 Q15078 2/20 0.51
DYRK2 Q92630 2/20 0.51
DYRK1B Q9Y463 2/20 0.51

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
SCHEMBL3031885 0.90 MKNK1 (1.00) MKNK1FYNKCNH2DYRK3CCNT1
SCHEMBL3033429 0.88 MKNK1 (1.00) MKNK1FYNKCNH2
SCHEMBL3033275 0.84 MKNK1 (0.76) MKNK1FYNKCNH2DYRK3CCNT1
SCHEMBL3042012 0.83 MKNK1 (0.85) MKNK1FYNKCNH2
SCHEMBL3045303 0.81 MKNK1 (0.71) MKNK1FYNKCNH2DYRK3CCNT1
SCHEMBL3040054 0.80 MKNK1 (0.69) MKNK1FYNKCNH2DYRK3CCNT1
SCHEMBL3043433 0.80 MKNK1 (0.80) MKNK1FYNKCNH2
SCHEMBL3036704 0.79 MKNK1 (0.77) MKNK1FYNKCNH2DYRK3CCNT1
SCHEMBL3043819 0.79 MKNK1 (0.77) MKNK1FYNKCNH2DYRK3CCNT1
SCHEMBL3036459 0.79 MKNK1 (0.82) MKNK1FYN

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
US-20100216798-A1 FUSED HETEROCYCLES AS LCK INHIBITORS ASTELLAS PHARMA INC (JP) 2010-08-26 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-20100216798-A1 FUSED HETEROCYCLES AS LCK INHIBITORS LCK, ZAP70, FYN MKNK1 816/4885FYN 3/4885KCNH2 235/4885

“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.