SCHEMBL2940349

SCHEMBL2940349

O=C1CN(Cc2ccnc(-c3ccc(F)cc3)c2)C(=O)N1c1ccc(S(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.40

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.40
TRPA1 O75762 8/20 0.38
SCN9A Q15858 1/20 0.38
IGF1R P08069 2/20 0.38
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
HTR1A P08908 1/20 0.36
DRD2 P14416 1/20 0.36
TAS2R8 Q9NYW2 2/20 0.36
PTGS2 P35354 2/20 0.35
UGCG Q16739 1/20 0.34

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
SCHEMBL2940235 0.92 ENPP2 (0.42) ENPP2IGF1RPPARDPPARAPTGS2
SCHEMBL2943201 0.92 ENPP2 (0.48) ENPP2IGF1RPPARDPPARATAS2R8
SCHEMBL2934095 0.89 SMN1; SMN2 (0.42) ENPP2TRPA1IGF1RPPARDPPARA
SCHEMBL2937377 0.86 IGF1R (0.43) ENPP2IGF1RPPARDPPARATAS2R8
SCHEMBL2940436 0.86 IGF1R (0.42) ENPP2SCN9AIGF1RPPARDPPARA
SCHEMBL2940997 0.86 ENPP2 (0.42) ENPP2IGF1RPPARDPPARATAS2R8
SCHEMBL2935234 0.84 IGF1R (0.48) ENPP2IGF1R
SCHEMBL2938753 0.84 TRPA1 (0.46) ENPP2TRPA1SCN9APPARDPPARA
SCHEMBL2934212 0.84 IGF1R (0.37) ENPP2IGF1RPPARDPPARATAS2R8
SCHEMBL2936080 0.84 IGF1R (0.43) ENPP2IGF1RPPARDPPARATAS2R8

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 ENPP2 3905/4885TRPA1 4151/4885SCN9A 2296/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA ENPP2 3920/4885TRPA1 4103/4885SCN9A 2453/4885

“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.