SCHEMBL5659684

SCHEMBL5659684

COC(=O)c1ccc(CN2C[C@@H]3C[C@H]2CN3C(C)C(=O)Nc2ccc(Oc3ccccc3)cc2)cc1

nearest known ligand 0.61

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 10/20 0.61
FAAH O00519 1/20 0.44
ALOX15 P16050 1/20 0.44
MAPK1 P28482 1/20 0.44
HTT P42858 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
ALDH1A1 P00352 3/20 0.43
MEN1 O00255 1/20 0.43
KMT2A Q03164 1/20 0.43
DRD2 P14416 1/20 0.42
GRIN2B Q13224 1/20 0.41
MAPT P10636 1/20 0.41
GAA P10253 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41

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
SCHEMBL5661801 1.00 LTA4H (0.61) LTA4HFAAHALOX15MAPK1HTT
SCHEMBL5310451 0.93 LTA4H (0.70) LTA4HDRD2
SCHEMBL5311202 0.84 LTA4H (0.84) LTA4HFAAHHTTSMN1; SMN2ALDH1A1
SCHEMBL5310458 0.76 LTA4H (1.00) LTA4H
SCHEMBL3032189 0.75 LTA4H (0.78) LTA4H
SCHEMBL3039063 0.71 LTA4H (0.46) LTA4HALDH1A1MEN1KMT2AGAA
SCHEMBL5591610 0.71 LTA4H (0.46) LTA4HALDH1A1MEN1KMT2AGAA
SCHEMBL3776077 0.71 MEN1 (0.51) SMN1; SMN2ALDH1A1MEN1KMT2AMAPT
SCHEMBL3776075 0.71 MEN1 (0.51) SMN1; SMN2ALDH1A1MEN1KMT2AMAPT
SCHEMBL3042583 0.71 LTA4H (0.61) LTA4HFAAH

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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 56/4885ALOX15 29/4885

“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.