SCHEMBL2939618

SCHEMBL2939618

O=C1N(c2ccc(S(=O)(=O)C(F)(F)F)cc2)C(=O)C2(CC2)N1Cc1ccnc2ccc(N3CCCCC3)cc12

nearest known ligand 0.59

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 7/20 0.59
LMNA P02545 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.42
IP6K1 Q92551 3/20 0.36
IP6K3 Q96PC2 1/20 0.34
MCHR1 Q99705 3/20 0.34
TRPV3 Q8NET8 1/20 0.34
MAP4K4 O95819 1/20 0.33
IDO1 P14902 1/20 0.32
TDO2 P48775 1/20 0.32
IDO2 Q6ZQW0 1/20 0.32
AR P10275 1/20 0.31
KCNH2 Q12809 2/20 0.31
CYP3A4 P08684 1/20 0.31

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
SCHEMBL2940608 0.94 IGF1R (0.58) IGF1RLMNAMAPK1HTTSMN1; SMN2
SCHEMBL2941853 0.90 IGF1R (0.74) IGF1RLMNAMAPK1HTTSMN1; SMN2
SCHEMBL2935047 0.88 IGF1R (0.63) IGF1RMCHR1TRPV3KCNH2CYP3A4
SCHEMBL2942008 0.87 IGF1R (0.62) IGF1RMCHR1TRPV3
SCHEMBL2997211 0.87 IGF1R (0.64) IGF1RMCHR1KCNH2
SCHEMBL2938134 0.87 IGF1R (0.62) IGF1RLMNAMAPK1HTTSMN1; SMN2
SCHEMBL2934068 0.86 IGF1R (0.78) IGF1RLMNAMAPK1HTTSMN1; SMN2
SCHEMBL2938150 0.86 IGF1R (0.45) IGF1R
SCHEMBL2939072 0.86 IGF1R (0.42) IGF1RIP6K1IP6K3MCHR1MAP4K4
SCHEMBL2941657 0.85 IGF1R (0.61) IGF1RMCHR1CYP3A4

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 IGF1R 1595/4885LMNA 1988/4885MAPK1 53/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA IGF1R 962/4885LMNA 2970/4885MAPK1 42/4885

“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.