SCHEMBL5312332

SCHEMBL5312332

O=C(CN1CCN(S(=O)(=O)c2cccc(C(=O)O)c2)CC1)Nc1ccc(Oc2ccccc2)cc1

nearest known ligand 0.74

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
CHRNB4 P30926 3/20 0.64
CHRNA3 P32297 3/20 0.64
CHRNB2 P17787 2/20 0.64
CHRNA4 P43681 2/20 0.64
LTA4H P09960 2/20 0.61
LMNA P02545 5/20 0.59
SMN1; SMN2 Q16637 3/20 0.59
GAA P10253 2/20 0.59
MAPT P10636 2/20 0.59
HTT P42858 2/20 0.59
ALDH1A1 P00352 4/20 0.57
GLA P06280 2/20 0.57
MEN1 O00255 1/20 0.57
KMT2A Q03164 1/20 0.57
L3MBTL1 Q9Y468 1/20 0.56
HPGD P15428 1/20 0.56
HSD17B10 Q99714 1/20 0.56

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
SCHEMBL5312758 0.89 LTA4H (0.70) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL5309852 0.85 LTA4H (0.71) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL5658691 0.80 LMNA (0.74) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL5312991 0.79 LTA4H (0.80) LTA4HLMNASMN1; SMN2GAAMAPT
SCHEMBL1001319 0.79 ALDH1A1 (0.81) LMNASMN1; SMN2GAAMAPTALDH1A1
SCHEMBL5663465 0.78 LTA4H (0.66) LTA4HLMNASMN1; SMN2GAAMAPT
SCHEMBL5314323 0.77 LTA4H (0.64) LTA4HLMNASMN1; SMN2GAAMAPT
SCHEMBL5661871 0.76 ALDH1A1 (0.69) CHRNB4CHRNA3CHRNB2CHRNA4LTA4H
SCHEMBL5317908 0.76 LTA4H (1.00) LTA4HLMNASMN1; SMN2GAAMAPT
SCHEMBL5315377 0.76 LTA4H (0.76) LTA4HLMNASMN1; SMN2GAAMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2007079003-A2 AMIDE INHIBITORS OF LEUKOTRIENE A4 HYDROLASE BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2007-07-12 WO disclosed
US-20070155727-A1 Amide inhibitors of leukotriene A4 hydrolase SCHERING AKTIENGESSELLSCHAFT (DE) 2007-07-05 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-20070155727-A1 Amide inhibitors of leukotriene A4 hydrolase LTA4H, LTB4R, LTC4S CHRNB4 1080/4885CHRNA3 1485/4885CHRNB2 2083/4885

“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.