SCHEMBL2938296

SCHEMBL2938296

O=C(NCc1ccccc1)Nc1cc(CN2CC(=O)N(c3ccc(S(=O)(=O)C(F)(F)F)cc3)C2=O)ccn1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 6/20 0.43
IGF1R P08069 6/20 0.42
MAPK1 P28482 5/20 0.41
ENPP2 Q13822 2/20 0.38
PPARD Q03181 1/20 0.37
PPARA Q07869 1/20 0.37

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
SCHEMBL2942090 0.90 EPHX2 (0.40) NAMPTIGF1RENPP2PPARDPPARA
SCHEMBL2935703 0.88 RAB9A (0.41) IGF1RENPP2PPARDPPARA
SCHEMBL2934702 0.86 IGF1R (0.57) IGF1RMAPK1
SCHEMBL2940241 0.86 PPARA (0.42) NAMPTIGF1RMAPK1PPARDPPARA
SCHEMBL2938394 0.86 NR3C2 (0.45) IGF1RPPARDPPARA
SCHEMBL2938006 0.86 IGF1R (0.49) IGF1RENPP2PPARDPPARA
SCHEMBL3724588 0.86 IGF1R (0.39) IGF1RENPP2PPARDPPARA
SCHEMBL2938771 0.85 IGF1R (0.41) NAMPTIGF1RMAPK1ENPP2PPARD
SCHEMBL2940329 0.85 RAB9A (0.39) IGF1RMAPK1PPARDPPARA
SCHEMBL2991289 0.84 KDM4E (0.42) IGF1RENPP2PPARDPPARA

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 NAMPT 1562/4885IGF1R 1595/4885MAPK1 53/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA NAMPT 1795/4885IGF1R 962/4885MAPK1 42/4885

“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.