SCHEMBL5314749

SCHEMBL5314749

CN(CC(=O)Nc1ccc(Oc2ccccc2)cc1)C1CCN(c2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.76

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 15/20 0.76
KDM4E B2RXH2 2/20 0.59
PKM P14618 1/20 0.59
MAPT P10636 2/20 0.53
LMNA P02545 1/20 0.53
POLB P06746 1/20 0.50
NPC1 O15118 1/20 0.50
GALR3 O60755 1/20 0.50
ALDH1A1 P00352 1/20 0.50
NR2F2 P24468 1/20 0.50
HTT P42858 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50

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
SCHEMBL5313205 0.87 LTA4H (1.00) LTA4HKDM4EPKM
SCHEMBL5317774 0.86 LTA4H (0.68) LTA4HKDM4EPKMMAPTALDH1A1
SCHEMBL5311020 0.85 LTA4H (0.77) LTA4HKDM4EPKM
SCHEMBL5661210 0.85 LTA4H (0.66) LTA4HKDM4EPKMLMNASMN1; SMN2
SCHEMBL5658663 0.84 KDM4E (0.79) LTA4HKDM4EPKMMAPTLMNA
SCHEMBL5330981 0.83 LTA4H (1.00) LTA4HKDM4EPKM
SCHEMBL5661246 0.83 LTA4H (1.00) LTA4HKDM4EPKM
SCHEMBL5336973 0.83 LTA4H (1.00) LTA4HKDM4EPKM
SCHEMBL5336961 0.83 LTA4H (1.00) LTA4HKDM4EPKM
SCHEMBL5334833 0.82 LTA4H (0.84) LTA4HKDM4EPKM

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 1/4885KDM4E 1019/4885PKM 4335/4885

“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.