SCHEMBL12284448

SCHEMBL12284448

CNC(=O)c1ccc2c(c1)nc(-c1c[nH]c(-c3ccc(OC)cc3)n1)n2CCOC

nearest known ligand 0.56

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ PTGER4 P35408 15/20 0.56
▸ RIPK2 O43353 1/20 0.50
▸ KDM4E B2RXH2 1/20 0.47
▸ ALDH1A1 P00352 1/20 0.47
▸ SMN1; SMN2 Q16637 1/20 0.47
▸ CHEK2 O96017 1/20 0.46
▸ MAPT P10636 1/20 0.44
▸ HDAC1 Q13547 1/20 0.43
▸ HDAC8 Q9BY41 1/20 0.43

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
SCHEMBL14576558 0.91 RIPK2 (0.60) PTGER4RIPK2CHEK2
SCHEMBL12285201 0.91 PTGER4 (0.53) PTGER4RIPK2
SCHEMBL12286225 0.89 PTGER4 (0.53) PTGER4RIPK2
SCHEMBL12284105 0.88 CRBN (0.51) PTGER4RIPK2MAPT
SCHEMBL12286422 0.88 PTGER4 (0.53) PTGER4RIPK2
SCHEMBL12284235 0.88 PTGER4 (0.49) PTGER4RIPK2MAPT
SCHEMBL12286421 0.88 PTGER4 (0.52) PTGER4RIPK2KDM4E
SCHEMBL14576893 0.87 PTGER4 (0.53) PTGER4RIPK2
SCHEMBL12286148 0.86 PTGER4 (0.53) PTGER4RIPK2
SCHEMBL12286266 0.86 PTGER4 (0.53) PTGER4RIPK2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — US claimed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — US disclosed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — US disclosed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 — — US disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 — — WO 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-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K3 PTGER4 3190/4885RIPK2 255/4885KDM4E 764/4885

“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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