SCHEMBL2939754

SCHEMBL2939754

CN1CCN(CC(=O)NC(c2ccncc2)N2C(=O)N(c3ccc(OC(F)(F)F)cc3)C(=O)C2(C)C)CC1

nearest known ligand 0.48

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 2/20 0.48
MEN1 O00255 1/20 0.48
ATM Q13315 1/20 0.48
GPR139 Q6DWJ6 6/20 0.41
KCNA5 P22460 2/20 0.40
SLC6A2 P23975 2/20 0.38
SLC6A4 P31645 2/20 0.38
ALDH1A1 P00352 1/20 0.37
IGF1R P08069 1/20 0.36
TRPV4 Q9HBA0 2/20 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
SCHEMBL2939352 0.87 IGF1R (0.51) IGF1RTRPV4
SCHEMBL2940341 0.86 IGF1R (0.40) KMT2AMEN1ATMALDH1A1IGF1R
SCHEMBL2940231 0.85 KMT2A (0.48) KMT2AMEN1ATMGPR139KCNA5
SCHEMBL2937313 0.83 CACNA1G (0.41) GPR139ALDH1A1IGF1R
SCHEMBL2939396 0.83 KMT2A (0.47) KMT2AMEN1ATMGPR139KCNA5
SCHEMBL2939980 0.80 CTSD (0.37) IGF1R
SCHEMBL2932737 0.77 KMT2A (0.51) KMT2AMEN1ATMKCNA5IGF1R
SCHEMBL3727200 0.74 IGF1R (0.57) KMT2AMEN1ATMIGF1R
SCHEMBL2938065 0.74 LTA4H (0.39) SLC6A2SLC6A4IGF1R
SCHEMBL2938168 0.71 IGF1R (0.40) KMT2AMEN1ATMALDH1A1IGF1R

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 KMT2A 2567/4885MEN1 1754/4885ATM 298/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA KMT2A 2761/4885MEN1 2077/4885ATM 599/4885

“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.