SCHEMBL14507243

SCHEMBL14507243

CN1C=C(c2cnc3c(Nc4cccc(-c5csc(N)n5)c4)nccn23)CN1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 1/20 0.41
▸ AURKA O14965 5/20 0.39
▸ AURKB Q96GD4 4/20 0.39
▸ TTK P33981 3/20 0.36
▸ MEN1 O00255 2/20 0.36
▸ ALDH1A1 P00352 2/20 0.36
▸ HPGD P15428 2/20 0.36
▸ KMT2A Q03164 2/20 0.36
▸ LMNA P02545 1/20 0.36
▸ HTT P42858 1/20 0.36
▸ MAPKAPK5 Q8IW41 2/20 0.35
▸ FYN P06241 1/20 0.35
▸ MAPT P10636 2/20 0.33
▸ HK1 P19367 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ HKDC1 Q2TB90 1/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ PTK6 Q13882 1/20 0.33
▸ PKM P14618 2/20 0.33
▸ FLT3 P36888 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
SCHEMBL8240979 0.84 AURKA (0.58) EGFRAURKAAURKBTTKMEN1
SCHEMBL14529900 0.80 TTK (0.50) AURKAAURKBTTKMAPKAPK5FYN
SCHEMBL15146186 0.79 FYN (0.49) EGFRAURKAAURKBTTKMAPKAPK5
SCHEMBL14507206 0.77 TTK (0.41) AURKAAURKBTTKMAPKAPK5FYN
SCHEMBL14537080 0.72 AURKA (0.45) AURKAAURKBTTKMAPKAPK5FLT3
SCHEMBL14536947 0.71 AURKA (0.44) EGFRAURKAAURKBTTKMAPKAPK5
SCHEMBL14530729 0.71 AURKA (0.51) EGFRAURKAAURKBTTKMAPKAPK5
SCHEMBL14530725 0.70 ABL1 (0.40) EGFRAURKAAURKBTTKMEN1
SCHEMBL14530155 0.70 AURKA (0.43) AURKAAURKBTTKMAPKAPK5FLT3
SCHEMBL14529936 0.70 PTK6 (0.35) AURKAAURKBTTKMAPKAPK5PTK6

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 EGFR 966/4885AURKA 5/4885AURKB 24/4885

“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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