SCHEMBL2940047

SCHEMBL2940047

CC1C(=O)N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C(=O)N1Cc1ccncc1NC(=O)C1CCCCC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 2/20 0.55
RXFP1 Q9HBX9 1/20 0.38
EPHX2 P34913 1/20 0.36
CHKA P35790 3/20 0.34
MAPK1 P28482 1/20 0.34
LMNA P02545 1/20 0.33
GSK3B P49841 3/20 0.33
MAPT P10636 2/20 0.33
HDAC3 O15379 1/20 0.33
HDAC1 Q13547 1/20 0.33
HDAC2 Q92769 1/20 0.33
ALDH1A1 P00352 1/20 0.33
THRB P10828 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
CTSS P25774 1/20 0.32
GSK3A P49840 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
SCHEMBL2938690 0.92 IGF1R (0.53) IGF1REPHX2CHKAGSK3BMAPT
SCHEMBL2939954 0.88 IGF1R (0.60) IGF1RRXFP1LMNAGSK3BMAPT
SCHEMBL2937193 0.87 IGF1R (0.58) IGF1RPTGS1PTGS2CTSS
SCHEMBL2937893 0.87 IGF1R (0.62) IGF1RRXFP1GSK3BPTGS1PTGS2
SCHEMBL2937079 0.87 GSK3B (0.41) IGF1REPHX2MAPK1LMNAGSK3B
SCHEMBL2942814 0.87 IGF1R (0.39) IGF1RRXFP1GSK3BMAPTHDAC3
SCHEMBL2938199 0.84 RXFP1 (0.39) IGF1RRXFP1EPHX2CHKAMAPK1
SCHEMBL2937967 0.84 IGF1R (0.56) IGF1RRXFP1LMNAMAPTALDH1A1
SCHEMBL2941779 0.84 IGF1R (0.61) IGF1RRXFP1LMNAHDAC1ALDH1A1
SCHEMBL2941498 0.84 IGF1R (0.64) IGF1RMAPK1LMNAPTGS1PTGS2

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 IGF1R 1595/4885RXFP1 2972/4885EPHX2 3969/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA IGF1R 962/4885RXFP1 2467/4885EPHX2 3424/4885

“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.