SCHEMBL14507223

SCHEMBL14507223

Cn1cc(-c2cnc3c(Nc4cccc5ccccc45)nccn23)cn1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ AURKA O14965 6/20 0.57
▸ AURKB Q96GD4 5/20 0.57
▸ TTK P33981 2/20 0.41
▸ CHEK1 O14757 1/20 0.41
▸ ALK Q9UM73 1/20 0.39
▸ FLT3 P36888 2/20 0.38
▸ EGFR P00533 1/20 0.37
▸ ERBB2 P04626 1/20 0.37
▸ ERBB4 Q15303 1/20 0.37
▸ FYN P06241 3/20 0.37
▸ BRD4 O60885 1/20 0.37
▸ ULK1 O75385 1/20 0.36
▸ ALDH1A1 P00352 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ CYP2D6 P10635 1/20 0.36
▸ CYP2C9 P11712 1/20 0.36
▸ HPGD P15428 1/20 0.36
▸ CYP2C19 P33261 1/20 0.36
▸ SMN1; SMN2 Q16637 1/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36

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
SCHEMBL8247441 0.91 AURKA (0.54) AURKAAURKBTTKCHEK1FLT3
SCHEMBL8241664 0.89 AURKA (0.57) AURKAAURKBTTKCHEK1ALK
SCHEMBL8246844 0.88 AURKA (0.55) AURKAAURKBTTKCHEK1ALK
SCHEMBL8246860 0.87 AURKA (0.57) AURKAAURKBTTKCHEK1FLT3
SCHEMBL8240825 0.85 AURKA (0.59) AURKAAURKBTTKCHEK1ALK
SCHEMBL8247273 0.83 AURKA (0.69) AURKAAURKBTTKCHEK1ALK
SCHEMBL8246957 0.83 AURKA (0.57) AURKAAURKBTTKALKFLT3
SCHEMBL8240923 0.82 AURKA (0.59) AURKAAURKBTTKCHEK1ALK
SCHEMBL8240162 0.82 AURKA (0.62) AURKAAURKBTTKFLT3EGFR
SCHEMBL8241637 0.81 AURKA (0.60) AURKAAURKBTTKCHEK1FLT3

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 AURKA 5/4885AURKB 24/4885TTK 69/4885

“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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