SCHEMBL5310022

SCHEMBL5310022

COC(=O)c1ccc(N2CCC(N(C)CC(=O)Nc3ccc(Oc4ccccc4)cc3)CC2)nc1

nearest known ligand 0.61

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 7/20 0.61
KDM4E B2RXH2 1/20 0.55
PKM P14618 1/20 0.55
KMT2A Q03164 2/20 0.51
NPC1 O15118 1/20 0.51
RAB9A P51151 1/20 0.51
DGAT1 O75907 2/20 0.49
ALDH1A1 P00352 1/20 0.47
GAA P10253 1/20 0.47
MAPT P10636 1/20 0.47
TSHR P16473 1/20 0.47
CYP3A4 P08684 1/20 0.46
SOAT1 P35610 1/20 0.46
P2RY12 Q9H244 1/20 0.46
MCHR1 Q99705 1/20 0.45
TDP1 Q9NUW8 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
CA12 O43570 2/20 0.44
CA1 P00915 2/20 0.44
CA2 P00918 2/20 0.44

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
SCHEMBL5317774 0.93 LTA4H (0.68) LTA4HKDM4EPKMDGAT1ALDH1A1
SCHEMBL5660796 0.86 MAPT (0.64) LTA4HKDM4EPKMKMT2ARAB9A
SCHEMBL5314749 0.81 LTA4H (0.76) LTA4HKDM4EPKMNPC1ALDH1A1
SCHEMBL5317785 0.81 LTA4H (0.56) LTA4HDGAT1
SCHEMBL5658663 0.79 KDM4E (0.79) LTA4HKDM4EPKMKMT2ARAB9A
SCHEMBL5314241 0.78 LTA4H (0.87) LTA4HKDM4EPKMKMT2AALDH1A1
SCHEMBL5661221 0.77 LTA4H (0.47) LTA4HKDM4EPKMKMT2ANPC1
SCHEMBL5333260 0.76 LTA4H (0.57) LTA4HKDM4EPKMKMT2ARAB9A
SCHEMBL5311020 0.76 LTA4H (0.77) LTA4HKDM4EPKM
SCHEMBL5334522 0.76 LTA4H (0.86) LTA4HKDM4EPKMKMT2AALDH1A1

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.