SCHEMBL3727464

SCHEMBL3727464

CSc1ccc(N2C(=O)C(C)(C)[N+](Cc3ccncc3)(OC(=O)C(F)(F)F)C2=O)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
IGF1R P08069 14/20 0.41
TACR1 P25103 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TRIP13 Q15645 1/20 0.31
CYP3A4 P08684 1/20 0.31
GAA P10253 1/20 0.31
CYP2C9 P11712 1/20 0.31
CYP2C19 P33261 1/20 0.31
NPC1 O15118 1/20 0.30
RAB9A P51151 1/20 0.30

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
SCHEMBL4885935 0.90 IGF1R (0.39) IGF1RTRIP13CYP3A4CYP2C9CYP2C19
SCHEMBL3737891 0.90 IGF1R (0.39) IGF1RTRIP13CYP3A4GAACYP2C9
SCHEMBL3734617 0.87 IGF1R (0.37) IGF1RCYP3A4GAACYP2C9CYP2C19
SCHEMBL4884670 0.85 IGF1R (0.34) IGF1RTRIP13CYP3A4CYP2C9CYP2C19
SCHEMBL4879679 0.85 NR1H2 (0.36) IGF1RSMN1; SMN2TRIP13CYP3A4GAA
SCHEMBL4884428 0.84 IGF1R (0.33) IGF1RSMN1; SMN2TRIP13CYP3A4GAA
SCHEMBL4884585 0.84 IGF1R (0.36) IGF1RSMN1; SMN2CYP3A4GAACYP2C9
SCHEMBL4890256 0.84 NAMPT (0.40) IGF1RCYP3A4CYP2C9CYP2C19
SCHEMBL3729237 0.83 DRD2 (0.36) IGF1R
SCHEMBL4882154 0.82 IGF1R (0.32) IGF1R

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 4 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
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 1595/4885TACR1 4003/4885SMN1; SMN2 3761/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA IGF1R 962/4885TACR1 3588/4885SMN1; SMN2 4365/4885

“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.