SCHEMBL2939860

SCHEMBL2939860

CC1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)N1Cc1ccnc(NC(=O)Nc2ccccc2)c1

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.47
KMT2A Q03164 1/20 0.47
GAA P10253 1/20 0.44
SMO Q99835 2/20 0.43
KDR P35968 4/20 0.42
BRAF P15056 3/20 0.42
LMNA P02545 1/20 0.41
TSHR P16473 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
MAPK1 P28482 1/20 0.41
P2RY1 P47900 1/20 0.41
RAF1 P04049 1/20 0.41
EPHX2 P34913 1/20 0.41
TP53 P04637 3/20 0.41
IGF1R P08069 2/20 0.41
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MAPT P10636 2/20 0.40

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
SCHEMBL2938507 0.93 SMO (0.41) MEN1KMT2AGAASMOKDR
SCHEMBL2939023 0.92 SMO (0.46) MEN1KMT2ASMOKDRBRAF
SCHEMBL2940163 0.91 SMO (0.43) MEN1KMT2ASMOMAPK1EPHX2
SCHEMBL3732841 0.89 SMO (0.46) GAASMOTP53IGF1RNPC1
SCHEMBL2942473 0.89 IGF1R (0.50) GAASMOLMNATSHRL3MBTL1
SCHEMBL3729685 0.89 CACNA1H (0.48) MEN1KMT2AGAASMOL3MBTL1
SCHEMBL2940171 0.89 SMO (0.43) GAASMOTP53IGF1R
SCHEMBL2937051 0.89 GAA (0.47) GAASMOLMNATSHRL3MBTL1
SCHEMBL2940830 0.88 IGF1R (0.49) SMOBRAFTSHRMAPK1IGF1R
SCHEMBL2936696 0.88 NR3C2 (0.44) SMOIGF1R

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 MEN1 1754/4885KMT2A 2567/4885GAA 1964/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA MEN1 2077/4885KMT2A 2761/4885GAA 2768/4885

“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.