SCHEMBL2547562

SCHEMBL2547562

COCCn1c(-c2c[nH]c(-c3ccc4scnc4c3)n2)nc2c(N3CCN(C)[C@@H](C)C3)nccc21

nearest known ligand 0.32

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ KDM1A O60341 1/20 0.32
▸ MAP3K11 Q16584 1/20 0.32
▸ WDR5 P61964 1/20 0.32
▸ DYRK2 Q92630 1/20 0.31
▸ DRD2 P14416 1/20 0.30
▸ DRD3 P35462 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
SCHEMBL2549697 0.90 MAP3K11 (0.38) KDM1AMAP3K11DYRK2DRD2DRD3
SCHEMBL2551140 0.90 TTK (0.38) —
SCHEMBL2554752 0.90 MAP3K11 (0.34) KDM1AMAP3K11DYRK2DRD2DRD3
SCHEMBL2552056 0.90 RPS6KA5 (0.35) KDM1AMAP3K11DYRK2DRD2DRD3
SCHEMBL2546139 0.89 RPS6KA5 (0.34) KDM1AMAP3K11DYRK2DRD2DRD3
SCHEMBL2548897 0.88 CCNT1 (0.37) —
SCHEMBL14616826 0.87 RIPK2 (0.38) KDM1ADRD2DRD3
SCHEMBL2553463 0.86 MTOR (0.35) —
SCHEMBL2551527 0.86 MTOR (0.35) —
SCHEMBL14576181 0.84 TTK (0.30) DYRK2

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 4 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
EP-2552208-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS Glaxo Group Limited (GB) 2013-02-06 — — EP 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 KDM1A 628/4885MAP3K11 19/4885WDR5 2992/4885

“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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