SCHEMBL5313100

SCHEMBL5313100

CN(Cc1ccc(C(=O)O)cc1)C[C@@H]1CCN(CC(=O)Nc2ccc(Oc3ccccc3)cc2)C1

nearest known ligand 0.72

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 17/20 0.72
LMNA P02545 1/20 0.53
GAA P10253 1/20 0.53
SMN1; SMN2 Q16637 1/20 0.53
ACHE P22303 1/20 0.52
MEN1 O00255 1/20 0.52
ALDH1A1 P00352 1/20 0.52
GLA P06280 1/20 0.52
KMT2A Q03164 1/20 0.52

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
SCHEMBL5313108 1.00 LTA4H (0.72) LTA4HLMNAGAASMN1; SMN2ACHE
SCHEMBL5314085 1.00 LTA4H (0.72) LTA4HLMNAGAASMN1; SMN2ACHE
SCHEMBL5316003 0.95 LTA4H (0.77) LTA4HLMNAGAASMN1; SMN2ACHE
SCHEMBL5310435 0.93 LTA4H (0.69) LTA4HLMNAGAASMN1; SMN2ACHE
SCHEMBL3036317 0.86 LTA4H (0.59) LTA4H
SCHEMBL3043719 0.86 LTA4H (0.59) LTA4H
SCHEMBL3036320 0.86 LTA4H (0.59) LTA4H
SCHEMBL3030733 0.86 LTA4H (0.59) LTA4H
SCHEMBL3030738 0.86 LTA4H (0.59) LTA4H
SCHEMBL3036315 0.86 LTA4H (0.59) 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 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 1402/4885GAA 1586/4885

“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.