SCHEMBL5313809

SCHEMBL5313809

CCC(C(=O)Nc1ccc(Oc2ccccc2)cc1)N1CCCN(Cc2ccc(C(=O)O)cc2)CC1

nearest known ligand 0.67

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 14/20 0.67
FAAH O00519 2/20 0.52
MCHR2 Q969V1 1/20 0.49
MCHR1 Q99705 1/20 0.49
DRD2 P14416 1/20 0.47
KMT2A Q03164 1/20 0.46
HSD17B10 Q99714 1/20 0.46
GAA P10253 1/20 0.46

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
SCHEMBL5660153 0.90 LTA4H (0.54) LTA4HFAAHMCHR2MCHR1DRD2
SCHEMBL5657184 0.89 LTA4H (0.57) LTA4HFAAHMCHR2MCHR1
SCHEMBL5310186 0.89 LTA4H (0.69) LTA4HFAAHMCHR2MCHR1DRD2
SCHEMBL3043169 0.81 LTA4H (0.77) LTA4HFAAH
SCHEMBL5312528 0.81 CYP2D6 (0.47) LTA4HFAAHGAA
SCHEMBL5312794 0.81 LTA4H (1.00) LTA4HKMT2AGAA
SCHEMBL5310443 0.80 FAAH (0.78) LTA4HFAAH
SCHEMBL5312878 0.80 LTA4H (0.59) LTA4HFAAHMCHR2MCHR1DRD2
SCHEMBL5662078 0.79 LTA4H (0.56) LTA4HFAAHDRD2KMT2AGAA
SCHEMBL5661406 0.79 LTA4H (0.71) LTA4HFAAHMCHR2MCHR1KMT2A

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 1/4885FAAH 56/4885MCHR2 3683/4885

“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.