SCHEMBL14507206

SCHEMBL14507206

CN1C=C(c2cnc3c(Nc4cccnc4)nccn23)CN1

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
▸ TTK P33981 1/20 0.41
▸ AURKA O14965 6/20 0.40
▸ MAP4K4 O95819 1/20 0.39
▸ CCNA2 P20248 2/20 0.39
▸ CDK2 P24941 2/20 0.39
▸ CCNA1 P78396 2/20 0.39
▸ CDK5 Q00535 2/20 0.39
▸ DYRK1A Q13627 2/20 0.39
▸ CDK5R1 Q15078 2/20 0.39
▸ AURKB Q96GD4 5/20 0.36
▸ MAPKAPK5 Q8IW41 3/20 0.36
▸ FLT3 P36888 2/20 0.35
▸ LCK P06239 1/20 0.35
▸ NAMPT P43490 1/20 0.34
▸ FYN P06241 1/20 0.34

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
SCHEMBL14529900 0.90 TTK (0.50) TTKAURKAAURKBMAPKAPK5FLT3
SCHEMBL15146186 0.83 FYN (0.49) TTKAURKAAURKBMAPKAPK5FLT3
SCHEMBL14530729 0.80 AURKA (0.51) TTKAURKAAURKBMAPKAPK5FYN
SCHEMBL14530725 0.79 ABL1 (0.40) TTKAURKAAURKBLCK
SCHEMBL14537080 0.79 AURKA (0.45) TTKAURKAAURKBMAPKAPK5FLT3
SCHEMBL8247128 0.78 AURKA (0.63) TTKAURKAMAP4K4CCNA2CDK2
SCHEMBL14387671 0.77 MAPKAPK5 (0.41) TTKAURKAMAP4K4CCNA2CDK2
SCHEMBL14507243 0.77 EGFR (0.41) TTKAURKAAURKBMAPKAPK5FLT3
SCHEMBL14530155 0.75 AURKA (0.43) TTKAURKAAURKBMAPKAPK5FLT3
SCHEMBL14536961 0.72 FLT3 (0.51) TTKFLT3

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-20070105864-A1 Methods for inhibiting protein kinases SCHERING CORPORATION 2007-05-10 — — US disclosed
US-20070105864-A1 Methods for inhibiting protein kinases SCHERING CORPORATION 2007-05-10 — — 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-20070105864-A1 Methods for inhibiting protein kinases PIM1, PIM2, PIM3 TTK 69/4885AURKA 5/4885MAP4K4 53/4885

“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.

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