SCHEMBL13658641

SCHEMBL13658641

CC(C)(C)OC(=O)NC(CF)Cc1ccc([N+](=O)[O-])cc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PPARG P37231 1/20 0.53
PPARA Q07869 1/20 0.53
ATM Q13315 1/20 0.49
LMNA P02545 1/20 0.49
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
ITGA4 P13612 1/20 0.43
ITGB7 P26010 1/20 0.43
CTSS P25774 4/20 0.42
CTSK P43235 4/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
ALDH1A1 P00352 1/20 0.42
MAPK1 P28482 1/20 0.42
NPC1 O15118 1/20 0.42
TP53 P04637 1/20 0.42
RAB9A P51151 1/20 0.42

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
SCHEMBL7465229 0.89 LMNA (0.63) PPARGPPARAATMLMNAMEN1
SCHEMBL14532784 0.89 LMNA (0.63) PPARGPPARAATMLMNAMEN1
SCHEMBL6539801 0.89 LMNA (0.63) PPARGPPARAATMLMNAMEN1
SCHEMBL30454910 0.88 PPARG (0.55) PPARGPPARAATMLMNAMEN1
SCHEMBL2789840 0.87 PPARG (0.54) PPARGPPARAATMLMNAMEN1
SCHEMBL2617240 0.87 PPARG (0.54) PPARGPPARAATMLMNAMEN1
SCHEMBL2789835 0.87 PPARG (0.54) PPARGPPARAATMLMNAMEN1
SCHEMBL2617242 0.86 PPARG (0.51) PPARGPPARAATMLMNAMEN1
SCHEMBL30454282 0.85 PPARG (0.50) PPARGPPARAATMLMNAMEN1
SCHEMBL17728765 0.85 PPARG (0.58) PPARGPPARAATMLMNAMEN1

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-20090246130-A1 Methods and Compositions for F-18 Labeling of Proteins, Peptides and Other Molecules IMMUNOMEDICS, INC. (US) 2009-10-01 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-20090246130-A1 Methods and Compositions for F-18 Labeling of Proteins, Peptides and Other Molecules F13B, TFRC, F13A1 PPARG 4461/4885PPARA 4677/4885ATM 4510/4885

“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.