SCHEMBL13767657

SCHEMBL13767657

[2H]C([2H])([2H])n1cc(Cc2ccc(C(=O)OC)cc2OC)c2cc([N+](=O)[O-])ccc21

nearest known ligand 0.61

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
PLA2G4A P47712 11/20 0.61
LTB4R Q15722 4/20 0.61
CYSLTR2 Q9NS75 1/20 0.41
CYSLTR1 Q9Y271 1/20 0.41
F2 P00734 1/20 0.41
PLAU P00749 1/20 0.41
KLKB1 P03952 1/20 0.41
ELANE P08246 1/20 0.41
CTRB1 P17538 1/20 0.41

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
SCHEMBL3679305 0.93 PLA2G4A (0.61) PLA2G4ALTB4R
SCHEMBL13767685 0.93 PLA2G4A (0.55) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL13767647 0.88 PLA2G4A (0.54) PLA2G4ALTB4R
SCHEMBL9117646 0.86 PLA2G4A (0.73) PLA2G4ALTB4RCYSLTR2CYSLTR1
SCHEMBL10562872 0.86 PLA2G4A (0.60) PLA2G4ALTB4RCYSLTR2CYSLTR1F2
SCHEMBL13767658 0.84 PLA2G4A (0.59) PLA2G4ALTB4R
SCHEMBL28392455 0.84 PLA2G4A (0.58) PLA2G4ALTB4R
SCHEMBL8951394 0.83 PLA2G4A (0.56) PLA2G4ALTB4RCYSLTR2CYSLTR1F2
SCHEMBL8532687 0.81 CPT2 (0.53)
SCHEMBL9226275 0.81 PLA2G4A (0.55) PLA2G4ALTB4RCYSLTR2CYSLTR1

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-20090191183-A1 SUBSTITUTED INDOLES AUSPEX PHARMACEUTICALS, INC. (US) 2009-07-30 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-20090191183-A1 SUBSTITUTED INDOLES CYSLTR1, LTB4R, LTB4R2 PLA2G4A 144/4885LTB4R 2/4885CYSLTR2 4/4885

“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.