SCHEMBL2931345

SCHEMBL2931345

CC1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)N1Cc1ccncc1NS(C)(=O)=O

nearest known ligand 0.46

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 1/20 0.46
KIF11 P52732 1/20 0.36
CCR9 P51686 2/20 0.36
SMO Q99835 3/20 0.36
PTGS1 P23219 7/20 0.35
PTGS2 P35354 5/20 0.35
FPR2 P25090 1/20 0.34
SLC22A12 Q96S37 2/20 0.33
KCNA5 P22460 1/20 0.33
KCNH2 Q12809 1/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 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
SCHEMBL2938748 0.92 IGF1R (0.45) IGF1RCCR9SMOPOLBL3MBTL1
SCHEMBL2937956 0.91 IGF1R (0.45) IGF1RCCR9SMOPOLBL3MBTL1
SCHEMBL2942733 0.91 IGF1R (0.44) IGF1RCCR9SMOKCNH2POLB
SCHEMBL2936563 0.89 IGF1R (0.49) IGF1RCCR9SMO
SCHEMBL2939965 0.89 IGF1R (0.44) IGF1RCCR9SMOPOLBL3MBTL1
SCHEMBL2932100 0.88 IGF1R (0.46) IGF1RCCR9SMOPTGS1PTGS2
SCHEMBL2939226 0.88 IGF1R (0.46) IGF1RCCR9SMO
SCHEMBL2934733 0.88 CCR9 (0.46) IGF1RCCR9SMO
SCHEMBL2944009 0.87 IGF1R (0.43) IGF1RSMOPOLBL3MBTL1
SCHEMBL2941931 0.86 IGF1R (0.62) IGF1RKIF11SMOPTGS1PTGS2

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 IGF1R 1595/4885KIF11 2253/4885CCR9 3896/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA IGF1R 962/4885KIF11 2508/4885CCR9 4016/4885

“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.