SCHEMBL4466284

SCHEMBL4466284

Cn1cc(C2CN(S(=O)(=O)c3ccccc3)c3ncc(C4=CCC5(CC4)OCCO5)cc32)cn1

nearest known ligand 0.32

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.32
SUV39H2 Q9H5I1 1/20 0.32
WNT1 P04628 1/20 0.30
GSK3B P49841 1/20 0.30
DYRK1A Q13627 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
SCHEMBL4460501 0.89 POLB (0.31) POLB
SCHEMBL4453845 0.78 PDPK1 (0.33) WNT1GSK3BDYRK1A
SCHEMBL4458088 0.77 MAPK8 (0.34) WNT1GSK3BDYRK1A
SCHEMBL4457073 0.76 HDAC3 (0.35) WNT1GSK3BDYRK1A
SCHEMBL12652368 0.75 HTR6 (0.33) POLB
SCHEMBL2753133 0.74 PDPK1 (0.42) POLBSUV39H2WNT1GSK3BDYRK1A
SCHEMBL13505776 0.72 DRD3 (0.32) POLB
SCHEMBL10226083 0.70 CSF1R (0.30)
SCHEMBL4461941 0.67 PIK3CD (0.33)
SCHEMBL4457148 0.67 KDM4E (0.36)

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-8178552-B2 7-Azaindole derivatives and their use in the inhibition of c-Jun N-terminal kinase EISAI R&D MANAGEMENT CO., LTD. (JP) 2012-05-15 US disclosed
US-20100069354-A1 7-AZAINDOLE DERIVATIVES AND THEIR USE IN THE INHIBITION OF C-JUN N-TERMINAL KINASE EISAI R&D MANAGEMENT CO., LTD. (JP) 2010-03-18 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-20100069354-A1 7-AZAINDOLE DERIVATIVES AND THEIR USE IN THE INHIBITION OF C-JUN N-TERMINAL KINASE MAPK7, MAPK13, MAPKAPK5 POLB 4206/4885SUV39H2 1963/4885WNT1 1637/4885

“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.