SCHEMBL5659628

SCHEMBL5659628

CNCCCN(C)CC(=O)Nc1ccc(OCc2ccccc2)cc1

nearest known ligand 0.71

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 12/20 0.71
LMNA P02545 1/20 0.58
POLB P06746 1/20 0.58
MAPT P10636 1/20 0.58
HTT P42858 1/20 0.58
RAB9A P51151 4/20 0.57
SMN1; SMN2 Q16637 3/20 0.57
ALDH1A1 P00352 3/20 0.57
NPC1 O15118 2/20 0.57
NOX1 Q9Y5S8 1/20 0.55

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
SCHEMBL5659446 0.86 LTA4H (0.78) LTA4H
SCHEMBL5333739 0.82 LTA4H (0.80) LTA4H
SCHEMBL3823095 0.77 LTA4H (0.62) LTA4HLMNAPOLBMAPTHTT
SCHEMBL5659966 0.76 LTA4H (1.00) LTA4H
SCHEMBL2170643 0.75 LTA4H (0.76) LTA4HRAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL4075780 0.75 LTA4H (0.84) LTA4HLMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL3224230 0.75 LTA4H (0.76) LTA4HLMNARAB9ASMN1; SMN2ALDH1A1
SCHEMBL5660215 0.74 LTA4H (0.82) LTA4HPOLBALDH1A1
SCHEMBL11340022 0.74 RAB9A (0.69) LTA4HRAB9ASMN1; SMN2ALDH1A1NPC1
SCHEMBL5313760 0.74 LTA4H (0.86) LTA4H

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-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 LTA4H 1/4885LMNA 1402/4885POLB 1455/4885

“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.