SCHEMBL6288010

SCHEMBL6288010

CC(C)c1cnc(NC(=O)NCc2ccccc2)s1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CDK2 P24941 8/20 0.69
CDK5 Q00535 7/20 0.69
CCNE1 P24864 6/20 0.69
CCNT1 O60563 1/20 0.69
ALDH1A1 P00352 1/20 0.69
CDK1 P06493 1/20 0.69
CDK4 P11802 1/20 0.69
CCNB1 P14635 1/20 0.69
CCNA2 P20248 1/20 0.69
CCND1 P24385 1/20 0.69
CDK7 P50613 1/20 0.69
CDK9 P50750 1/20 0.69
CCNH P51946 1/20 0.69
MNAT1 P51948 1/20 0.69
CDK5R1 Q15078 1/20 0.69
SMN1; SMN2 Q16637 1/20 0.69
ATG4B Q9Y4P1 10/20 0.61
GSK3A P49840 2/20 0.61
GSK3B P49841 2/20 0.61
DYRK1A Q13627 1/20 0.61

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
SCHEMBL6283555 0.89 ATG4B (0.62) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6287963 0.88 CDK2 (0.61) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6286739 0.88 ATG4B (0.64) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6285422 0.88 ATG4B (0.63) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6286130 0.88 ATG4B (0.63) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6287944 0.86 ATG4B (0.66) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6278437 0.85 GSK3B (0.66) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6279160 0.85 CDK2 (0.53) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6285945 0.85 CCNE1 (0.62) CDK2CDK5CCNE1CCNT1ALDH1A1
SCHEMBL6288035 0.84 CDK2 (0.52) CDK2CDK5CCNE1CCNT1ALDH1A1

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PEVARELLO PAOLO (IT) 2004-08-12 US claimed
US-20030187040-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2003-10-02 US claimed
US-6863647-B2 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN S.P.A. (IT) 2005-03-08 US disclosed
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PEVARELLO PAOLO (IT) 2004-08-12 US disclosed
US-20030187040-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents PHARMACIA & UPJOHN SPA (IT) 2003-10-02 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-20030187040-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 CDK2 3/4885CDK5 129/4885CCNE1 83/4885
US-20040157827-A1 2-Ureido-thiazole derivatives, process for their preparation, and their use as antitumor agents UCK2, ULK3, CDK2 CDK2 3/4885CDK5 129/4885CCNE1 83/4885

“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.