SCHEMBL3733356

SCHEMBL3733356

CC1C(=O)N(c2ccc(OC(F)(F)F)cc2)C(=O)N1Cc1ccnc(OCCN2CCCC2)c1

nearest known ligand 0.43

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TLR7 Q9NYK1 1/20 0.43
SMO Q99835 5/20 0.38
IGF1R P08069 2/20 0.38
ESR1 P03372 1/20 0.37
MCHR1 Q99705 2/20 0.37
KCNH2 Q12809 2/20 0.37
SLC6A4 P31645 2/20 0.36
SLC6A3 Q01959 2/20 0.36
HTR2C P28335 2/20 0.36
HTR2A P28223 1/20 0.36
HTR2B P41595 1/20 0.36
HCRTR1 O43613 4/20 0.35
HCRTR2 O43614 4/20 0.35
CYP3A4 P08684 1/20 0.35
ABL1 P00519 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
SCHEMBL2938666 0.86 IGF1R (0.48) SMOIGF1RHCRTR1HCRTR2
SCHEMBL2938151 0.85 SMO (0.43) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2940003 0.83 HCRTR1 (0.44) SMOIGF1RMCHR1HCRTR1HCRTR2
SCHEMBL2935811 0.83 SMO (0.49) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL4856947 0.82 TLR7 (0.47) TLR7IGF1RESR1MCHR1KCNH2
SCHEMBL2941667 0.82 SMO (0.47) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL3728670 0.82 IGF1R (0.57) TLR7IGF1R
SCHEMBL2935401 0.81 SMO (0.45) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2933455 0.81 SMO (0.45) SMOIGF1RHCRTR1HCRTR2CYP3A4
SCHEMBL2941134 0.81 IGF1R (0.41) SMOIGF1RMCHR1KCNH2HTR2C

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 TLR7 4130/4885SMO 2187/4885IGF1R 1595/4885
US-20040248884-A1 Novel cyclic urea derivatives, preparation thereof and pharmaceutical use thereof as kinase inhibitors PRKG1, PRKACA, PRKCA TLR7 4145/4885SMO 2697/4885IGF1R 962/4885

“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.