SCHEMBL13619699

SCHEMBL13619699

CC(C)N1C(=O)N(C)C(=O)C1C

nearest known ligand 0.38

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
BRD4 O60885 15/20 0.38
GRM4 Q14833 1/20 0.37
CDK9 P50750 7/20 0.32
ALDH1A1 P00352 1/20 0.31
MAPT P10636 1/20 0.31

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
SCHEMBL27497619 0.80 ALDH1A1 (0.33) ALDH1A1MAPT
SCHEMBL23941238 0.78 GRM4 (0.30) GRM4
SCHEMBL19923615 0.77 GRM4 (0.37) BRD4GRM4
SCHEMBL1362914 0.76
SCHEMBL11625745 0.74 PKM (0.30) ALDH1A1MAPT
SCHEMBL19923713 0.72 GRM4 (0.33) GRM4
SCHEMBL19923460 0.72 GRM4 (0.35) GRM4
SCHEMBL19923751 0.71 GRM4 (0.32) GRM4
SCHEMBL1363071 0.71 ALDH1A1 (0.31) ALDH1A1MAPT
SCHEMBL22702279 0.71 PIK3CD (0.38) GRM4ALDH1A1

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-20090281101-A1 THERAPEUTIC SUBSTITUTED HYDANTOINS, AND RELATED COMPOUNDS ALLERGAN, INC. (US) 2009-11-12 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-20090281101-A1 THERAPEUTIC SUBSTITUTED HYDANTOINS, AND RELATED COMPOUNDS AADAC, ABCG2, SLC10A1 BRD4 398/4885GRM4 2880/4885CDK9 2161/4885

“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.