SCHEMBL2940201

SCHEMBL2940201

O=C(c1cnccc1CN1CC(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C1=O)N1CCOCC1

nearest known ligand 0.38

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SLC6A9 P48067 3/20 0.38
PTGS2 P35354 2/20 0.36
IGF1R P08069 2/20 0.35
SMN1; SMN2 Q16637 3/20 0.35
LMNA P02545 1/20 0.34
MAPK1 P28482 1/20 0.34
HTT P42858 1/20 0.34
USP2 O75604 1/20 0.34
NAMPT P43490 2/20 0.33
AOC3 Q16853 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
AKR1C3 P42330 1/20 0.32

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
SCHEMBL2937997 0.92 LMNA (0.37) SLC6A9IGF1RSMN1; SMN2LMNAMAPK1
SCHEMBL2939416 0.90 IGF1R (0.37) SLC6A9IGF1RHTTNAMPTAOC3
SCHEMBL2938068 0.90 SLC6A9 (0.41) SLC6A9IGF1RSMN1; SMN2LMNAMAPK1
SCHEMBL2931783 0.89 HTT (0.35) IGF1RSMN1; SMN2LMNAMAPK1HTT
SCHEMBL2938114 0.86 IGF1R (0.39) IGF1RSMN1; SMN2LMNAMAPK1HTT
SCHEMBL3726808 0.86 IGF1R (0.37) SLC6A9IGF1RSMN1; SMN2NAMPTMEN1
SCHEMBL2938294 0.86 EPHX2 (0.41) SMN1; SMN2NAMPT
SCHEMBL2937085 0.85 IGF1R (0.38) IGF1RSMN1; SMN2LMNAMAPK1HTT
SCHEMBL2939086 0.84 HTT (0.38) SLC6A9IGF1RSMN1; SMN2LMNAMAPK1
SCHEMBL2939708 0.83 IGF1R (0.44) SLC6A9PTGS2IGF1RNAMPT

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 SLC6A9 4115/4885PTGS2 2449/4885IGF1R 1595/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA SLC6A9 4221/4885PTGS2 2223/4885IGF1R 962/4885

“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.