SCHEMBL14616812

SCHEMBL14616812

COCCn1c(-c2cnc(-c3ccc4scnc4c3)[nH]2)nc2c(N3CCC3)nccc21

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ RIPK2 O43353 1/20 0.41
▸ KCNH2 Q12809 2/20 0.34
▸ RPS6KA5 O75582 1/20 0.33
▸ DYRK2 Q92630 4/20 0.32
▸ DRD2 P14416 3/20 0.31
▸ KDM1A O60341 1/20 0.31
▸ HTR6 P50406 2/20 0.31
▸ CASR P41180 1/20 0.31
▸ PTGER4 P35408 1/20 0.31
▸ MAP3K11 Q16584 1/20 0.31
▸ DRD3 P35462 1/20 0.31
▸ CNR2 P34972 1/20 0.30

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
SCHEMBL14616813 0.98 RIPK2 (0.41) RIPK2KCNH2RPS6KA5DYRK2DRD2
SCHEMBL14616824 0.98 RIPK2 (0.40) RIPK2KCNH2RPS6KA5DYRK2DRD2
SCHEMBL14616825 0.95 RIPK2 (0.40) RIPK2KCNH2DYRK2DRD2MAP3K11
SCHEMBL14616807 0.93 RIPK2 (0.40) RIPK2
SCHEMBL14616826 0.90 RIPK2 (0.38) RIPK2DRD2KDM1ADRD3
SCHEMBL14616811 0.88 TTK (0.38) RIPK2CNR2
SCHEMBL2554752 0.86 MAP3K11 (0.34) KCNH2RPS6KA5DYRK2DRD2KDM1A
SCHEMBL14616808 0.86 RIPK2 (0.37) RIPK2
SCHEMBL14616809 0.86 RIPK2 (0.37) RIPK2
SCHEMBL14616820 0.85 RIPK2 (0.39) RIPK2KDM1A

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-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

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 RIPK2 255/4885KCNH2 1135/4885RPS6KA5 153/4885

“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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