SCHEMBL5313307

SCHEMBL5313307

O=C(CN1CCCN(Cc2ccc(C(=O)O)cc2)CC1)Nc1ccc(Oc2ccc(-n3cccc3)cc2)cc1

nearest known ligand 0.82

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 11/20 0.82
MEN1 O00255 3/20 0.56
KMT2A Q03164 3/20 0.56
HPGD P15428 1/20 0.56
ALDH1A1 P00352 1/20 0.55
GLA P06280 1/20 0.55
LMNA P02545 3/20 0.53
MAPT P10636 1/20 0.53
GAA P10253 1/20 0.52
SMN1; SMN2 Q16637 1/20 0.52
ATM Q13315 1/20 0.51
HRH3 Q9Y5N1 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
SCHEMBL5312794 0.90 LTA4H (1.00) LTA4HMEN1KMT2AHPGDALDH1A1
SCHEMBL3041379 0.89 LTA4H (0.62) LTA4HMEN1KMT2AHRH3
SCHEMBL5659713 0.87 LTA4H (0.86) LTA4HMEN1KMT2AHPGDALDH1A1
SCHEMBL5317908 0.87 LTA4H (1.00) LTA4HMEN1KMT2AHPGDALDH1A1
SCHEMBL5310104 0.83 LTA4H (0.86) LTA4HMEN1KMT2AHPGDALDH1A1
SCHEMBL5310987 0.82 LTA4H (0.83) LTA4HMEN1KMT2AHPGDALDH1A1
SCHEMBL5313213 0.81 LTA4H (0.78) LTA4HMEN1KMT2AALDH1A1LMNA
SCHEMBL5334833 0.81 LTA4H (0.84) LTA4H
SCHEMBL5312984 0.81 LTA4H (0.74) LTA4HMEN1KMT2AHPGDLMNA
SCHEMBL5312896 0.80 LTA4H (0.81) LTA4HMEN1KMT2AHPGDALDH1A1

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 3 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 claimed
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 1/4885MEN1 4385/4885KMT2A 1929/4885

“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.