SCHEMBL958765

SCHEMBL958765

CNS(=O)(=O)c1cc(C(N)c2c(C)c3ccc(OC(=O)N(C)C)cc3oc2=O)ccn1

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAP2K1 Q02750 18/20 0.54
RAF1 P04049 12/20 0.54
CYP3A4 P08684 1/20 0.47
CYP2C9 P11712 1/20 0.47
BRAF P15056 1/20 0.45
MEN1 O00255 1/20 0.38
KMT2A Q03164 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
GLA P06280 1/20 0.37
GAA P10253 1/20 0.37
HPGD P15428 1/20 0.37

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
SCHEMBL959569 0.71 MAP2K1 (0.54) MAP2K1RAF1CYP3A4CYP2C9
SCHEMBL961031 0.71 MAP2K1 (0.54) MAP2K1RAF1CYP3A4CYP2C9
SCHEMBL958976 0.71 MAP2K1 (0.57) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL14250641 0.70 MAP2K1 (0.75) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL958763 0.70 MAP2K1 (1.00) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL958868 0.69 MAP2K1 (0.51) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL12694009 0.69 MAP2K1 (0.86) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL959681 0.69 MAP2K1 (0.73) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL25144041 0.68 MAP2K1 (0.65) MAP2K1RAF1CYP3A4CYP2C9BRAF
SCHEMBL959595 0.68 MAP2K1 (0.55) MAP2K1RAF1CYP3A4CYP2C9BRAF

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-8569378-B2 p27 protein inducer Sakai, Toshiyuki (JP) 2013-10-29 US disclosed
US-20110009398-A1 p27 Protein Inducer CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) 2011-01-13 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-20110009398-A1 p27 Protein Inducer CDKN1A, CDK2, SKP2 MAP2K1 1179/4885RAF1 1656/4885CYP3A4 925/4885

“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.