SCHEMBL21711999

SCHEMBL21711999

Cc1ccncc1-c1cc(CNC(=O)O)cc(C(=O)NCc2cc(F)cc(Cl)c2)c1

nearest known ligand 0.74

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
WDR5 P61964 18/20 0.74
AURKA O14965 1/20 0.47
KMT2A Q03164 1/20 0.46

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
SCHEMBL21711849 0.93 WDR5 (0.72) WDR5AURKAKMT2A
SCHEMBL21711576 0.86 WDR5 (1.00) WDR5
SCHEMBL21711996 0.84 WDR5 (0.74) WDR5
SCHEMBL21712032 0.81 WDR5 (0.73) WDR5
SCHEMBL21711883 0.81 WDR5 (0.73) WDR5
SCHEMBL21711890 0.80 WDR5 (0.80) WDR5
SCHEMBL21711997 0.80 WDR5 (0.75) WDR5
SCHEMBL21712053 0.80 WDR5 (0.75) WDR5
SCHEMBL21711544 0.78 WDR5 (1.00) WDR5
SCHEMBL21711867 0.76 WDR5 (0.73) 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-10807959-B2 WDR5-MLL1 inhibitors and modulators VANDERBILT UNIVERSITY (US) 2020-10-20 US disclosed
US-20200055824-A1 WDR5-MLL1 INHIBITORS AND MODULATORS VANDERBILT UNIVERSITY 2020-02-20 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-10807959-B2 WDR5-MLL1 inhibitors and modulators WDR5, WDR1, WDR3 WDR5 1/4885AURKA 491/4885KMT2A 48/4885
US-20200055824-A1 WDR5-MLL1 INHIBITORS AND MODULATORS WDR5, WDR1, WDR3 WDR5 1/4885AURKA 491/4885KMT2A 48/4885

“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.