SCHEMBL2933455

SCHEMBL2933455

Cc1cc(CN2C(=O)N(c3ccc(OC(F)(F)F)cc3)C(=O)C2C)ccn1

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
SMO Q99835 5/20 0.45
IGF1R P08069 1/20 0.44
HCRTR1 O43613 11/20 0.40
HCRTR2 O43614 11/20 0.40
CYP3A4 P08684 2/20 0.39
POLB P06746 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39

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
SCHEMBL2935401 0.90 SMO (0.45) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2942310 0.89 SMO (0.49) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2937798 0.89 SMO (0.44) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2941426 0.89 IGF1R (0.45) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2939855 0.89 IGF1R (0.45) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL3738293 0.88 IGF1R (0.45) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2931144 0.88 SMO (0.43) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2940228 0.88 SMO (0.43) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2938151 0.88 SMO (0.43) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2938666 0.87 IGF1R (0.48) SMOIGF1RHCRTR1HCRTR2

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 SMO 2187/4885IGF1R 1595/4885HCRTR1 4640/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA SMO 2697/4885IGF1R 962/4885HCRTR1 4352/4885

“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.