SCHEMBL2931783

SCHEMBL2931783

O=C(NN1CCOCC1)c1cnccc1CN1CC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O

nearest known ligand 0.35

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.35
GAA P10253 1/20 0.35
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34
IGF1R P08069 2/20 0.34
CBLB Q13191 1/20 0.34
BCL2L1 Q07817 1/20 0.33
LMNA P02545 1/20 0.33
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NAMPT P43490 7/20 0.33
ADORA2A P29274 1/20 0.33
ALDH1A1 P00352 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARD Q03181 1/20 0.31
PPARA Q07869 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
SCHEMBL2940201 0.89 SLC6A9 (0.38) HTTIGF1RLMNAMAPK1SMN1; SMN2
SCHEMBL2939971 0.87 ABL1 (0.36) FLT1KDRCBLBPPARDPPARA
SCHEMBL2937069 0.87 IGF1R (0.36) HTTGAAFLT1KDRIGF1R
SCHEMBL2931316 0.87 IGF1R (0.39) HTTIGF1RLMNAMAPK1SMN1; SMN2
SCHEMBL2938114 0.84 IGF1R (0.39) HTTIGF1RLMNAMAPK1SMN1; SMN2
SCHEMBL2937085 0.84 IGF1R (0.38) HTTIGF1RLMNAMAPK1SMN1; SMN2
SCHEMBL2942835 0.84 RXFP1 (0.41) GAAFLT1KDRIGF1RLMNA
SCHEMBL2935945 0.83 IGF1R (0.54) HTTGAAFLT1KDRIGF1R
SCHEMBL2941199 0.83 IGF1R (0.54) IGF1RCBLBMAPK1NAMPT
SCHEMBL2939086 0.83 HTT (0.38) HTTIGF1RLMNAMAPK1SMN1; SMN2

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 HTT 3931/4885GAA 1964/4885FLT1 1539/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA HTT 4328/4885GAA 2768/4885FLT1 1130/4885

“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.