SCHEMBL2939587

SCHEMBL2939587

CC1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)N1Cc1ccncc1NC(=O)c1ccc(Cl)cc1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SMO Q99835 3/20 0.42
LIPE Q05469 1/20 0.40
IGF1R P08069 1/20 0.39
GCGR P47871 2/20 0.39
F10 P00742 1/20 0.38
MAPT P10636 3/20 0.38
GSK3A P49840 1/20 0.37
GSK3B P49841 1/20 0.37
NR3C1 P04150 1/20 0.37
NAMPT P43490 1/20 0.37
ABL1 P00519 2/20 0.37
TRPV1 Q8NER1 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
SCHEMBL2941929 0.93 IGF1R (0.39) IGF1RGCGRMAPTGSK3AGSK3B
SCHEMBL2937486 0.93 ABL1 (0.40) IGF1RGCGRMAPTGSK3AGSK3B
SCHEMBL2942973 0.92 IGF1R (0.43) SMOIGF1RGCGRGSK3AGSK3B
SCHEMBL2939003 0.91 LIPE (0.43) SMOLIPEIGF1RGSK3AGSK3B
SCHEMBL2939151 0.90 P2RY1 (0.43) SMOIGF1RMAPTNR3C1
SCHEMBL2933360 0.88 IGF1R (0.42) SMOIGF1RGSK3AGSK3BTRPV1
SCHEMBL2939536 0.88 TDP1 (0.42) SMOLIPEIGF1RMAPTGSK3A
SCHEMBL2938370 0.87 SMO (0.42) SMOIGF1R
SCHEMBL2939367 0.87 IGF1R (0.43) SMOIGF1RGCGRGSK3AGSK3B
SCHEMBL2934036 0.87 IGF1R (0.55) SMOIGF1RMAPTNAMPT

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 SMO 2187/4885LIPE 2214/4885IGF1R 1595/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA SMO 2697/4885LIPE 3248/4885IGF1R 962/4885

“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.