SCHEMBL2938149

SCHEMBL2938149

O=C(NNc1cnccc1CN1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)C12CC2)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
GCGR P47871 6/20 0.48
MCHR1 Q99705 7/20 0.39
F2R P25116 1/20 0.38
CYP3A4 P08684 4/20 0.37
TRPV1 Q8NER1 2/20 0.37
TLR7 Q9NYK1 1/20 0.36
NAMPT P43490 1/20 0.35
ALDH1A1 P00352 1/20 0.35
KDM5A P29375 1/20 0.35
KDM4C Q9H3R0 1/20 0.35
KDM5B Q9UGL1 1/20 0.35

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
SCHEMBL2936066 0.92 GCGR (0.50) GCGRMCHR1F2RTRPV1NAMPT
SCHEMBL2939984 0.90 IGF1R (0.42) GCGRTRPV1TLR7ALDH1A1
SCHEMBL2940629 0.88 IGF1R (0.44) MCHR1
SCHEMBL2941101 0.86 GCGR (0.46) GCGRMCHR1CYP3A4TRPV1NAMPT
SCHEMBL2941387 0.85 GCGR (0.43) GCGRMCHR1CYP3A4KDM4C
SCHEMBL2936589 0.85 GCGR (0.51) GCGRTRPV1NAMPT
SCHEMBL2938673 0.85 GCGR (0.44) GCGRMCHR1CYP3A4TRPV1KDM5A
SCHEMBL2934476 0.85 NPC1 (0.46) GCGRTRPV1NAMPT
SCHEMBL2938222 0.84 GCGR (0.52) GCGRMCHR1CYP3A4NAMPTALDH1A1
SCHEMBL2931754 0.84 TRPV1 (0.49) GCGRMCHR1TRPV1NAMPTKDM5A

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 GCGR 2462/4885MCHR1 4505/4885F2R 4074/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA GCGR 2407/4885MCHR1 4236/4885F2R 3674/4885

“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.