SCHEMBL21817439

SCHEMBL21817439

Cc1cnccc1-c1cc(CO)cc(C(=O)NCc2ccc(Cl)c(Cl)c2)c1

nearest known ligand 0.70

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 19/20 0.70
ROCK2 O75116 1/20 0.51

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
SCHEMBL21819557 0.94 WDR5 (0.70) WDR5
SCHEMBL21817441 0.87 WDR5 (0.75) WDR5ROCK2
SCHEMBL21817954 0.86 WDR5 (0.68) WDR5
SCHEMBL21817851 0.86 WDR5 (0.63) WDR5
SCHEMBL21817380 0.85 WDR5 (0.68) WDR5
SCHEMBL21711996 0.84 WDR5 (0.74) WDR5
SCHEMBL21817339 0.84 WDR5 (0.72) WDR5
SCHEMBL21711867 0.83 WDR5 (0.73) WDR5
SCHEMBL21818864 0.83 WDR5 (1.00) WDR5
SCHEMBL21818187 0.81 WDR5 (0.68) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10844044-B2 WDR5 inhibitors and modulators VANDERBILT UNIVERSITY (US) 2020-11-24 US disclosed
US-20200102288-A1 WDR5 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2020-04-02 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 (2 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-20200102288-A1 WDR5 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 WDR5 1/4885ROCK2 3318/4885
US-10844044-B2 WDR5 inhibitors and modulators WDR5, WDR1, WDR3 WDR5 1/4885ROCK2 3197/4885

“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.