SCHEMBL2934288

SCHEMBL2934288

COc1ccc(-c2cnccc2CN2CC(=O)N(c3ccc(OC(F)(F)F)cc3)C2=O)cc1

nearest known ligand 0.39

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CACNA1B Q00975 1/20 0.39
SLC22A12 Q96S37 2/20 0.39
TAS2R8 Q9NYW2 3/20 0.39
CYP11B1 P15538 2/20 0.39
CYP11B2 P19099 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.37
ALDH1A1 P00352 2/20 0.37
HTT P42858 1/20 0.37
PPARD Q03181 1/20 0.36
PPARA Q07869 1/20 0.36
ENPP2 Q13822 1/20 0.36
F10 P00742 1/20 0.36
DGAT2 Q96PD7 2/20 0.35
POLB P06746 1/20 0.34
RPS6KA3 P51812 1/20 0.34
L3MBTL1 Q9Y468 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
SCHEMBL2937776 0.92 ENPP2 (0.36) CACNA1BTAS2R8CYP11B2PPARDPPARA
SCHEMBL2938577 0.91 ENPP2 (0.38) CACNA1BPPARDPPARAENPP2
SCHEMBL2937503 0.91 ENPP2 (0.44) TAS2R8CYP11B1CYP11B2PPARDPPARA
SCHEMBL2939343 0.88 IGF1R (0.41) CACNA1BSLC22A12TAS2R8CYP11B1CYP11B2
SCHEMBL2935001 0.88 SLC22A12 (0.43) CACNA1BSLC22A12TAS2R8CYP11B1CYP11B2
SCHEMBL2941037 0.87 TAS2R8 (0.41) TAS2R8SMN1; SMN2ALDH1A1HTTPPARD
SCHEMBL2937375 0.84 PPARD (0.39) TAS2R8PPARDPPARAENPP2POLB
SCHEMBL2938937 0.84 PPARD (0.43) TAS2R8PPARDPPARAENPP2POLB
SCHEMBL2939220 0.84 FNTA (0.39) CYP11B1CYP11B2SMN1; SMN2ALDH1A1PPARD
SCHEMBL2939521 0.84 NISCH (0.46) TAS2R8PPARDPPARAENPP2POLB

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 CACNA1B 4752/4885SLC22A12 3963/4885TAS2R8 3914/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA CACNA1B 4689/4885SLC22A12 3835/4885TAS2R8 4047/4885

“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.