SCHEMBL2940923

SCHEMBL2940923

O=C1CN(Cc2ccnc(-c3ccccc3Cl)c2)C(=O)N1c1ccc(S(=O)(=O)C(F)(F)F)cc1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ENPP2 Q13822 2/20 0.41
AVPR2 P30518 1/20 0.40
AVPR1A P37288 1/20 0.40
IGF1R P08069 3/20 0.40
PTGS2 P35354 2/20 0.36
PPARD Q03181 2/20 0.35
PPARA Q07869 2/20 0.35
KCNN4 O15554 2/20 0.35
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
PTGS1 P23219 1/20 0.34
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
PPARG P37231 1/20 0.33
ADRB2 P07550 1/20 0.33
FPR1 P21462 1/20 0.33
GPR183 P32249 1/20 0.33
APLNR P35414 1/20 0.33
GLP1R P43220 1/20 0.33
GPBAR1 Q8TDU6 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
SCHEMBL2940436 0.87 IGF1R (0.42) ENPP2IGF1RPTGS2PPARDPPARA
SCHEMBL2943201 0.87 ENPP2 (0.48) ENPP2IGF1RPPARDPPARAMEN1
SCHEMBL2940235 0.86 ENPP2 (0.42) ENPP2AVPR2AVPR1AIGF1RPTGS2
SCHEMBL2940997 0.85 ENPP2 (0.42) ENPP2IGF1RPTGS2PPARDPPARA
SCHEMBL2936080 0.85 IGF1R (0.43) ENPP2IGF1RPTGS2PPARDPPARA
SCHEMBL2938633 0.85 IGF1R (0.47) ENPP2AVPR2AVPR1AIGF1R
SCHEMBL2940567 0.85 ENPP2 (0.41) ENPP2AVPR2AVPR1APPARDPPARA
SCHEMBL2940349 0.83 ENPP2 (0.40) ENPP2IGF1RPTGS2PPARDPPARA
SCHEMBL2941743 0.83 ENPP2 (0.44) ENPP2IGF1RPPARDPPARAMEN1
SCHEMBL2937377 0.82 IGF1R (0.43) ENPP2IGF1RPPARDPPARAPPARG

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 ENPP2 3905/4885AVPR2 3349/4885AVPR1A 4172/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA ENPP2 3920/4885AVPR2 2980/4885AVPR1A 3626/4885

“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.