SCHEMBL19998167

SCHEMBL19998167

O=C(Cc1cccnc1)NCc1cccc(-c2cn3c(n2)CCC3)c1

nearest known ligand 0.82

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 18/20 0.82
ERCC1 P07992 1/20 0.51
ERCC4 Q92889 1/20 0.51
LMNA P02545 1/20 0.49

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
SCHEMBL19998135 0.92 WDR5 (0.74) WDR5
SCHEMBL19998133 0.91 WDR5 (0.87) WDR5
SCHEMBL19997602 0.90 WDR5 (1.00) WDR5LMNA
SCHEMBL19997623 0.88 WDR5 (1.00) WDR5
SCHEMBL19998155 0.86 WDR5 (0.85) WDR5
SCHEMBL19998163 0.86 WDR5 (0.83) WDR5
SCHEMBL19997613 0.86 WDR5 (0.82) WDR5
SCHEMBL19998138 0.86 WDR5 (0.82) WDR5
SCHEMBL19998141 0.86 WDR5 (0.79) WDR5
SCHEMBL19997618 0.86 WDR5 (0.80) WDR5

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20180086767-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2018-03-29 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-20180086767-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR77 WDR5 1/4885ERCC1 1237/4885ERCC4 1182/4885

“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.