SCHEMBL3018161

SCHEMBL3018161

CC(=O)OCC(OC(C)=O)C(=O)Nc1c(I)c(C(=O)Cl)c(I)c(C(=O)NCC2COC(C)(C)O2)c1I

nearest known ligand 0.35

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
NAMPT P43490 3/20 0.35
CA2 P00918 1/20 0.32

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
SCHEMBL13247614 0.88 NAMPT (0.33) NAMPT
SCHEMBL9979410 0.85 NAMPT (0.37) NAMPTCA2
SCHEMBL11713000 0.84 NAMPT (0.39) NAMPTCA2
SCHEMBL9232549 0.84 NAMPT (0.38) NAMPTCA2
SCHEMBL3663814 0.83 NAMPT (0.41) NAMPTCA2
SCHEMBL3051827 0.83
SCHEMBL9238429 0.82 NAMPT (0.38) NAMPTCA2
SCHEMBL3663813 0.81 NAMPT (0.40) NAMPTCA2
SCHEMBL3026646 0.81 LMNA (0.36)
SCHEMBL9318639 0.80 LMNA (0.38)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8323619-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-12-04 US disclosed
US-8323619-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-12-04 US disclosed
US-8202511-B2 Contrast agents GE HEALTHCARE AS (NO) 2012-06-19 US disclosed
US-20100303734-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-12-02 US disclosed
US-20100303734-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-12-02 US disclosed
US-20100233097-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-16 US disclosed
US-20100233097-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-16 US disclosed
US-20100221192-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221192-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221189-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100221189-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-09-02 US disclosed
US-20100209356-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-08-19 US disclosed
US-20100209356-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-08-19 US disclosed
US-20100189656-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-07-29 US disclosed
US-20100189656-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-07-29 US disclosed
US-20100189656-A1 CONTRAST AGENTS GE HEALTHCARE AS (NO) 2010-07-29 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 (6 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-20100221189-A1 CONTRAST AGENTS NR1I3, NR1I2, NR1D2 NAMPT 4271/4885CA2 2213/4885
US-20100189656-A1 CONTRAST AGENTS IPO4, TPO, IPO11 NAMPT 2709/4885CA2 1826/4885
US-20100209356-A1 CONTRAST AGENTS C5, C1S, C1R NAMPT 4169/4885CA2 843/4885
US-20100221192-A1 CONTRAST AGENTS C5, C1S, C1R NAMPT 3639/4885CA2 818/4885
US-20100233097-A1 CONTRAST AGENTS C1R, C3AR1, CNKSR1 NAMPT 4481/4885CA2 440/4885
US-20100303734-A1 CONTRAST AGENTS C1R, CNKSR1, C5 NAMPT 3758/4885CA2 494/4885

“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.