SCHEMBL2939574

SCHEMBL2939574

O=C1CN(Cc2ccncc2-c2ccc(F)cc2)C(=O)N1c1ccc(SC(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 10/20 0.41
ENPP2 Q13822 2/20 0.36
CACNA1B Q00975 2/20 0.35
TAS2R8 Q9NYW2 3/20 0.35
SLC22A12 Q96S37 1/20 0.34
NTRK1 P04629 1/20 0.34
SCN9A Q15858 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
SCHEMBL2936272 0.92 IGF1R (0.42) IGF1RENPP2CACNA1BTAS2R8SLC22A12
SCHEMBL2940557 0.91 ENPP2 (0.44) IGF1RENPP2TAS2R8NTRK1SCN9A
SCHEMBL2939343 0.89 IGF1R (0.41) IGF1RENPP2CACNA1BTAS2R8SLC22A12
SCHEMBL2939185 0.86 IGF1R (0.44) IGF1RENPP2TAS2R8NTRK1SCN9A
SCHEMBL2937776 0.85 ENPP2 (0.36) ENPP2CACNA1BTAS2R8SCN9A
SCHEMBL2936877 0.85 IGF1R (0.40) IGF1RENPP2TAS2R8NTRK1
SCHEMBL2938292 0.84 IGF1R (0.39) IGF1RENPP2TAS2R8NTRK1
SCHEMBL2940357 0.84 IGF1R (0.43) IGF1RENPP2TAS2R8NTRK1SCN9A
SCHEMBL2940483 0.84 IGF1R (0.44) IGF1RENPP2TAS2R8NTRK1
SCHEMBL2941888 0.84 IGF1R (0.38) IGF1RENPP2CACNA1BTAS2R8SLC22A12

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 1595/4885ENPP2 3905/4885CACNA1B 4752/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA IGF1R 962/4885ENPP2 3920/4885CACNA1B 4689/4885

“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.