SCHEMBL2937332

SCHEMBL2937332

O=C(NN1CCOCC1)c1cnccc1CN1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)C12CC2

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.43
SCN2A Q99250 1/20 0.37
SCN10A Q9Y5Y9 1/20 0.37
KCNH2 Q12809 6/20 0.36
EBP Q15125 1/20 0.36
ABL1 P00519 2/20 0.35
CBLB Q13191 1/20 0.34
MCHR1 Q99705 5/20 0.34
CYP3A4 P08684 3/20 0.34
MMP1 P03956 1/20 0.33
MMP3 P08254 1/20 0.33
MMP9 P14780 1/20 0.33
MMP8 P22894 1/20 0.33
MMP13 P45452 1/20 0.33
MMP14 P50281 1/20 0.33

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
SCHEMBL2939875 0.91 IGF1R (0.40) GCGRSCN2ASCN10AKCNH2ABL1
SCHEMBL2938170 0.88 GCGR (0.41) GCGRSCN2ASCN10AKCNH2EBP
SCHEMBL2937710 0.88 IGF1R (0.43) KCNH2EBP
SCHEMBL2932166 0.86 GCGR (0.48) GCGRMCHR1CYP3A4
SCHEMBL2942195 0.84 GCGR (0.47) GCGRMCHR1CYP3A4
SCHEMBL2932824 0.84 GCGR (0.45) GCGRMCHR1CYP3A4MMP1MMP3
SCHEMBL2939971 0.83 ABL1 (0.36) SCN2ASCN10AKCNH2ABL1CBLB
SCHEMBL2941313 0.83 GCGR (0.46) GCGRKCNH2ABL1MCHR1
SCHEMBL2939602 0.83 GCGR (0.40) GCGRSCN2ASCN10AKCNH2EBP
SCHEMBL2940530 0.82 GCGR (0.42) GCGRMCHR1CYP3A4

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-7825115-B2 Cyclic urea compounds, preparation thereof and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2010-11-02 US disclosed
EP-1599464-B1 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA SA (FR) 2010-09-22 EP disclosed
US-20080108654-A1 Cyclic Urea Compounds, Preparation Thereof and Pharmaceutical Use Thereof as Kinase Inhibitors AVENTIS PHARMA S.A. (FR) 2008-05-08 US disclosed
US-7354933-B2 Protein kinase inhibitors; antitumor agents; such as 5-methyl-1-quinol-4-ylmethyl-3-(4-trifluoromethanesulfonylphenyl)imidazolidine-2,4-dione trifluoroacetate AVENTIS PHARMA SA (FR) 2008-04-08 US disclosed
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors AVENTIS PHARMA S.A. (FR) 2004-12-09 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-20080108654-A1 Cyclic Urea Compounds, Preparation Thereof and Pharmaceutical Use Thereof as Kinase Inhibitors PRKG1, PRKACA, CMPK1 GCGR 2462/4885SCN2A 3499/4885SCN10A 3047/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA GCGR 2407/4885SCN2A 3454/4885SCN10A 3037/4885

“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.