SCHEMBL3527704

SCHEMBL3527704

COC(=O)C(C)CN=C=O

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.35
CA14 Q9ULX7 3/20 0.35
CA12 O43570 2/20 0.35
ESRRB O95718 1/20 0.33
CA7 P43166 1/20 0.33
CA9 Q16790 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.31
CA1 P00915 1/20 0.31
CA2 P00918 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
SCHEMBL17577079 0.80 SMN1; SMN2 (0.38) SMN1; SMN2CA14CA12CA7CA9
SCHEMBL20095027 0.80 TSHR (0.38) SMN1; SMN2ALDH1A1
SCHEMBL21891911 0.79
SCHEMBL36191 0.78 SMN1; SMN2 (0.41) SMN1; SMN2CA14CA12ESRRBCA7
SCHEMBL16552424 0.78 SMN1; SMN2 (0.32) SMN1; SMN2CA14CA12ALDH1A1KMT2A
SCHEMBL28322420 0.77 ALDH1A1 (0.34) ALDH1A1
SCHEMBL29191766 0.76 CA1 (0.48) SMN1; SMN2KMT2ACA1CA2
SCHEMBL725123 0.76 SMN1; SMN2 (0.31) SMN1; SMN2
SCHEMBL27599259 0.76
SCHEMBL10792704 0.76

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-7759366-B2 Arylaminoaryl-alkyl-substituted imidazolidine-2,4-diones, process for preparing them, medicaments comprising these compounds, and their use SANOFI-AVENTIS (FR) 2010-07-20 US disclosed
US-20090215728-A1 Arylaminoaryl-alkyl-substituted imidazolidine-2,4-diones, process for preparing them, medicaments comprising these compounds, and their use SANOFI-AVENTIS (FR) 2009-08-27 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-20090215728-A1 Arylaminoaryl-alkyl-substituted imidazolidine-2,4-diones, process for preparing them, medicaments comprising these compounds, and their use GPR119, GIPR, LIPC SMN1; SMN2 4150/4885CA14 4878/4885CA12 4879/4885

“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.