SCHEMBL2940741

SCHEMBL2940741

O=C1N(c2ccc(OC(F)(F)F)cc2)C(=O)C2(CC2)N1Cc1ccnc2cc(Cl)ccc12

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 1/20 0.43
MAPT P10636 1/20 0.43
GCGR P47871 2/20 0.42
IGF1R P08069 2/20 0.42
DDR1 Q08345 4/20 0.38
CYP3A4 P08684 3/20 0.37
GAA P10253 1/20 0.37
MCHR1 Q99705 5/20 0.36
PRCP P42785 2/20 0.36
MAPK8 P45983 1/20 0.36

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
SCHEMBL2938243 0.94 IGF1R (0.43) KDM4EMAPTGCGRIGF1RDDR1
SCHEMBL2935636 0.90 IGF1R (0.43) GCGRIGF1RCYP3A4MCHR1
SCHEMBL2934884 0.89 IGF1R (0.44) GCGRIGF1RCYP3A4MCHR1
SCHEMBL3002517 0.89 IGF1R (0.42) GCGRIGF1RCYP3A4MCHR1
SCHEMBL2931384 0.89 IGF1R (0.44) GCGRIGF1RCYP3A4MCHR1
SCHEMBL2942071 0.88 IGF1R (0.55) KDM4EMAPTIGF1R
SCHEMBL2936252 0.88 GCGR (0.43) KDM4EMAPTGCGRIGF1RCYP3A4
SCHEMBL2938311 0.87 IGF1R (0.55) KDM4EGCGRIGF1RCYP3A4MCHR1
SCHEMBL2937951 0.87 GCGR (0.42) GCGRIGF1RCYP3A4MCHR1
SCHEMBL2933433 0.87 IGF1R (0.41) KDM4EMAPTGCGRIGF1RCYP3A4

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 KDM4E 1619/4885MAPT 1554/4885GCGR 2462/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA KDM4E 1464/4885MAPT 2136/4885GCGR 2407/4885

“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.