SCHEMBL2935703

SCHEMBL2935703

O=C(Nc1cc(CN2CC(=O)N(c3ccc(S(=O)(=O)C(F)(F)F)cc3)C2=O)ccn1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
RAB9A P51151 5/20 0.41
NPC1 O15118 4/20 0.41
PPARD Q03181 2/20 0.41
PPARA Q07869 2/20 0.41
ENPP2 Q13822 2/20 0.39
ALDH1A1 P00352 1/20 0.39
IGF1R P08069 6/20 0.38
PPARG P37231 1/20 0.37
HCK P08631 1/20 0.36
MAPK12 P53778 1/20 0.36
MAPK14 Q16539 1/20 0.36
TAS2R8 Q9NYW2 2/20 0.36
HDAC6 Q9UBN7 1/20 0.36

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
SCHEMBL2940685 0.93 NPC1 (0.42) RAB9ANPC1PPARDPPARAENPP2
SCHEMBL2938795 0.93 ACKR3 (0.43) RAB9ANPC1PPARDPPARAALDH1A1
SCHEMBL2932756 0.92 PPARD (0.40) RAB9ANPC1PPARDPPARAENPP2
SCHEMBL2938306 0.91 GRM5 (0.44) RAB9ANPC1PPARDPPARAENPP2
SCHEMBL2934573 0.90 HDAC6 (0.42) RAB9ANPC1PPARDPPARAALDH1A1
SCHEMBL2942090 0.89 EPHX2 (0.40) RAB9ANPC1PPARDPPARAENPP2
SCHEMBL2938895 0.89 IGF1R (0.38) PPARDPPARAENPP2ALDH1A1IGF1R
SCHEMBL2940329 0.89 RAB9A (0.39) RAB9ANPC1PPARDPPARAIGF1R
SCHEMBL2938006 0.88 IGF1R (0.49) RAB9ANPC1PPARDPPARAENPP2
SCHEMBL2938394 0.88 NR3C2 (0.45) PPARDPPARAIGF1R

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 RAB9A 1706/4885NPC1 2549/4885PPARD 3189/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA RAB9A 2275/4885NPC1 2042/4885PPARD 3572/4885

“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.