SCHEMBL4147217

SCHEMBL4147217

O=C(O)N1CC(COc2ccccc2I)C1

nearest known ligand 0.44

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RBP4 P02753 10/20 0.44
FABP7 O15540 1/20 0.40
FABP3 P05413 1/20 0.40
FABP5 Q01469 1/20 0.40
TTR P02766 5/20 0.37
HTR1A P08908 1/20 0.37
HTR7 P34969 1/20 0.37
THRA P10827 1/20 0.35
THRB P10828 1/20 0.35
CHRNA7 P36544 1/20 0.35
PTGDR2 Q9Y5Y4 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
SCHEMBL3951198 0.81 NAMPT (0.50) RBP4
SCHEMBL28086919 0.80 RBP4 (0.42) RBP4TTRTHRATHRBCHRNA7
SCHEMBL796697 0.80 MEN1 (0.49) CHRNA7
SCHEMBL25190938 0.79 RBP4 (0.57) RBP4TTR
SCHEMBL20744403 0.73 RBP4 (0.55) RBP4TTR
SCHEMBL13777973 0.71 SLC6A4 (0.39) HTR1A
SCHEMBL34475634 0.71 MCHR1 (0.49)
SCHEMBL21855171 0.71 AGTR2 (0.51)
SCHEMBL20744513 0.70 RBP4 (0.52) RBP4TTR
SCHEMBL5207932 0.70 RBP4 (0.52) RBP4TTR

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090170828-A1 Azetidine Derivatives as Inhibitors of Stearoyl-Coenzyme a Delta-9 Desaturase MERCK FROSST CANADA LTD. (CA) 2009-07-02 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 (1 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-20090170828-A1 Azetidine Derivatives as Inhibitors of Stearoyl-Coenzyme a Delta-9 Desaturase SCD, SCD5, FASN RBP4 663/4885FABP7 133/4885FABP3 106/4885

“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.