SCHEMBL2939072

SCHEMBL2939072

O=C1N(c2ccc(OC(F)(F)F)cc2)C(=O)C2(CC2)N1Cc1ccnc2ccc(N3CCCCC3)cc12

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.42
ENPP2 Q13822 1/20 0.40
GCGR P47871 2/20 0.39
TRPV1 Q8NER1 2/20 0.36
IP6K1 Q92551 2/20 0.36
MCHR1 Q99705 6/20 0.36
IP6K3 Q96PC2 1/20 0.35
CRHBP P24387 2/20 0.34
CRHR2 Q13324 2/20 0.34
TRPV4 Q9HBA0 1/20 0.34
CYP3A4 P08684 2/20 0.34
MAP4K4 O95819 1/20 0.33

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
SCHEMBL2933433 0.94 IGF1R (0.41) IGF1RENPP2GCGRMCHR1CRHBP
SCHEMBL2941182 0.90 IGF1R (0.53) IGF1RENPP2
SCHEMBL2937631 0.88 IGF1R (0.44) IGF1RGCGRTRPV1MCHR1TRPV4
SCHEMBL2942283 0.87 IGF1R (0.45) IGF1RGCGRMCHR1CYP3A4
SCHEMBL2939920 0.87 IGF1R (0.45) IGF1RENPP2GCGRTRPV1MCHR1
SCHEMBL2940672 0.87 IGF1R (0.43) IGF1RENPP2GCGRTRPV1MCHR1
SCHEMBL2938243 0.87 IGF1R (0.43) IGF1RGCGRTRPV1MCHR1CYP3A4
SCHEMBL2938150 0.87 IGF1R (0.45) IGF1R
SCHEMBL2939618 0.86 IGF1R (0.59) IGF1RIP6K1MCHR1IP6K3CYP3A4
SCHEMBL2938311 0.86 IGF1R (0.55) IGF1RGCGRMCHR1CYP3A4

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 7 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
EP-1599464-A2 NOVEL CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS Aventis Pharma S.A. (FR) 2005-11-30 EP 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
WO-2004070050-A2 CYCLIC UREA DERIVATIVES, PREPARATION METHOD THEREOF AND PHARMACEUTICAL USE OF SAME AS KINASE INHIBITORS AVENTIS PHARMA S.A. (FR) 2004-08-19 WO 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 3905/4885GCGR 2462/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA IGF1R 962/4885ENPP2 3920/4885GCGR 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.