SCHEMBL5310987

SCHEMBL5310987

COC(=O)c1ccc(CN2CCCN(CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)cc1

nearest known ligand 0.83

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.83
LMNA P02545 4/20 0.65
ALDH1A1 P00352 7/20 0.64
MEN1 O00255 6/20 0.64
KMT2A Q03164 6/20 0.64
GLA P06280 1/20 0.64
MAPT P10636 3/20 0.63
SMN1; SMN2 Q16637 2/20 0.63
GAA P10253 1/20 0.63
TSHR P16473 1/20 0.62
HTT P42858 1/20 0.62
HSD17B10 Q99714 1/20 0.62
FAAH O00519 1/20 0.60
HPGD P15428 1/20 0.59

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
SCHEMBL5314382 0.97 LTA4H (0.82) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5312794 0.91 LTA4H (1.00) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL3026400 0.89 CHKA (0.65) LTA4HALDH1A1MEN1KMT2AMAPT
SCHEMBL5664662 0.89 MEN1 (0.70) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5310997 0.87 LTA4H (0.67) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5317908 0.87 LTA4H (1.00) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5316117 0.87 FAAH (0.65) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5661543 0.87 LTA4H (0.81) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5312896 0.87 LTA4H (0.81) LTA4HLMNAALDH1A1MEN1KMT2A
SCHEMBL5310961 0.86 KMT2A (0.64) LTA4HLMNAALDH1A1MEN1KMT2A

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 LTA4H 1/4885LMNA 1402/4885ALDH1A1 1337/4885

“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.