SCHEMBL2940322

SCHEMBL2940322

CC1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)N1Cc1ccnc(C2CCCCC2)c1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HCRTR1 O43613 14/20 0.41
HCRTR2 O43614 14/20 0.41
GCGR P47871 1/20 0.41
GIPR P48546 1/20 0.41
IGF1R P08069 1/20 0.40
SMO Q99835 3/20 0.40
CYP3A4 P08684 1/20 0.37

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
SCHEMBL3736606 0.86 IGF1R (0.51) IGF1RSMO
SCHEMBL2941833 0.85 IGF1R (0.53) HCRTR1HCRTR2IGF1RSMO
SCHEMBL2937077 0.85 IGF1R (0.58) HCRTR1HCRTR2IGF1RSMO
SCHEMBL2935401 0.84 SMO (0.45) HCRTR1HCRTR2IGF1RSMOCYP3A4
SCHEMBL2933455 0.84 SMO (0.45) HCRTR1HCRTR2IGF1RSMOCYP3A4
SCHEMBL2940003 0.84 HCRTR1 (0.44) HCRTR1HCRTR2IGF1RSMOCYP3A4
SCHEMBL2931878 0.83 KDR (0.41) IGF1R
SCHEMBL2937798 0.83 SMO (0.44) HCRTR1HCRTR2IGF1RSMOCYP3A4
SCHEMBL2942310 0.83 SMO (0.49) HCRTR1HCRTR2IGF1RSMOCYP3A4
SCHEMBL2941426 0.83 IGF1R (0.45) HCRTR1HCRTR2IGF1RSMOCYP3A4

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 HCRTR1 4640/4885HCRTR2 4799/4885GCGR 2462/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA HCRTR1 4352/4885HCRTR2 4696/4885GCGR 2407/4885

“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.