SCHEMBL2938008

SCHEMBL2938008

COc1ccc(N(C)C(=O)c2cc(CN3CC(=O)N(c4ccc(OC(F)(F)F)cc4)C3=O)ccn2)cc1

nearest known ligand 0.42

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.42
ALDH1A1 P00352 1/20 0.42
PPARD Q03181 3/20 0.41
PPARA Q07869 3/20 0.41
HTT P42858 1/20 0.40
TAS2R8 Q9NYW2 3/20 0.38
PPARG P37231 2/20 0.38
BLM P54132 1/20 0.37
LMNA P02545 3/20 0.36
IGF1R P08069 3/20 0.35
TP53 P04637 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
EPHX2 P34913 1/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34

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
SCHEMBL2934046 0.93 PPARD (0.41) SMN1; SMN2ALDH1A1PPARDPPARAPPARG
SCHEMBL2935117 0.93 PPARD (0.44) SMN1; SMN2ALDH1A1PPARDPPARATAS2R8
SCHEMBL2934264 0.90 IGF1R (0.47) SMN1; SMN2ALDH1A1PPARDPPARAHTT
SCHEMBL2936938 0.89 SMN1; SMN2 (0.40) SMN1; SMN2ALDH1A1PPARDPPARAHTT
SCHEMBL2940220 0.89 PPARD (0.45) SMN1; SMN2ALDH1A1PPARDPPARAHTT
SCHEMBL2938007 0.84 ALDH1A1 (0.44) SMN1; SMN2ALDH1A1PPARDPPARAHTT
SCHEMBL2934887 0.84 IGF1R (0.47) SMN1; SMN2ALDH1A1PPARDPPARAHTT
SCHEMBL2935376 0.84 PPARD (0.48) SMN1; SMN2ALDH1A1PPARDPPARAPPARG
SCHEMBL2939229 0.83 GCGR (0.46) TAS2R8IGF1R
SCHEMBL2941005 0.83 IGF1R (0.55) PPARDPPARAPPARGIGF1R

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 SMN1; SMN2 3761/4885ALDH1A1 3413/4885PPARD 3189/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA SMN1; SMN2 4365/4885ALDH1A1 2827/4885PPARD 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.