SCHEMBL2935293

SCHEMBL2935293

CN(C)c1cnc2ccccc2c1CN1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)C12CC2

nearest known ligand 0.41

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
GCGR P47871 4/20 0.41
IGF1R P08069 2/20 0.39
ACP1 P24666 1/20 0.38
OPRL1 P41146 3/20 0.34
OPRM1 P35372 1/20 0.33
TEAD1 P28347 1/20 0.33
TEAD4 Q15561 1/20 0.33
TEAD2 Q15562 1/20 0.33
TEAD3 Q99594 1/20 0.33
MCHR1 Q99705 5/20 0.33
ENPP2 Q13822 1/20 0.33
NTRK1 P04629 1/20 0.33
LIPE Q05469 1/20 0.33
CXCR3 P49682 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
SCHEMBL2936850 0.90 IGF1R (0.49) IGF1RACP1TEAD1TEAD4TEAD2
SCHEMBL2936711 0.89 GCGR (0.42) GCGRIGF1RMCHR1ENPP2NTRK1
SCHEMBL2939719 0.88 GCGR (0.41) GCGRIGF1RMCHR1LIPE
SCHEMBL2943023 0.87 GCGR (0.41) GCGRIGF1RMCHR1
SCHEMBL2939105 0.87 GCGR (0.42) GCGRIGF1RMCHR1LIPE
SCHEMBL2936895 0.87 GCGR (0.41) GCGRIGF1ROPRL1MCHR1ENPP2
SCHEMBL2939377 0.86 IGF1R (0.46) IGF1RNTRK1
SCHEMBL2937513 0.86 GCGR (0.42) GCGRIGF1RMCHR1ENPP2NTRK1
SCHEMBL2937384 0.86 IGF1R (0.56) IGF1ROPRL1OPRM1MCHR1
SCHEMBL2937833 0.83 GCGR (0.39) GCGRIGF1RACP1MCHR1ENPP2

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 GCGR 2462/4885IGF1R 1595/4885ACP1 535/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA GCGR 2407/4885IGF1R 962/4885ACP1 525/4885

“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.