SCHEMBL6049753

SCHEMBL6049753

NC(CCCOc1ccc(Cc2ccccc2)cc1)CC(=O)O

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 14/20 0.54
FFAR1 O14842 3/20 0.50
L3MBTL1 Q9Y468 2/20 0.48
KDM4E B2RXH2 1/20 0.46
MEN1 O00255 1/20 0.46
ALDH1A1 P00352 1/20 0.46
KMT2A Q03164 1/20 0.46
LMNA P02545 1/20 0.46
MAPK1 P28482 1/20 0.46
CASP3 P42574 1/20 0.46
SENP7 Q9BQF6 1/20 0.46
SENP6 Q9GZR1 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
SCHEMBL6049755 1.00 LTA4H (0.54) LTA4HFFAR1L3MBTL1KDM4EMEN1
SCHEMBL6049744 0.96 LTA4H (0.56) LTA4HFFAR1L3MBTL1
SCHEMBL6049742 0.96 LTA4H (0.56) LTA4HFFAR1L3MBTL1
SCHEMBL6049748 0.93 LTA4H (0.54) LTA4HFFAR1L3MBTL1LMNAMAPK1
SCHEMBL6049751 0.93 LTA4H (0.54) LTA4HFFAR1L3MBTL1LMNAMAPK1
SCHEMBL6049799 0.88 TDP1 (0.53) LTA4HL3MBTL1ALDH1A1KMT2A
Bromide SCHEMBL6049771 0.82 LTA4H (0.56) LTA4HL3MBTL1
Bromide SCHEMBL6049769 0.82 LTA4H (0.56) LTA4HL3MBTL1
SCHEMBL5681063 0.81 LTA4H (0.57) LTA4HL3MBTL1
Hydrochloric Acid SCHEMBL5679740 0.80 LTA4H (0.55) LTA4HL3MBTL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6878723-B1 Carbocyclic and/or heterocyclic amino carboxylic acids, e.g., 2-aminomethyl-6-(p-benzylphenoxy)hexanoic acid; leukotriene A4 hydrolase; treating arthritis and psoriasis; hematoprotective and antimitotic agents INSTITUT NATIONAL DE LA SANTE ET DE LA RESCHERCHE MEDICALE (INSERM) (FR) 2005-04-12 US claimed
EP-1165491-B1 LTA4 HYDROLASE INHIBITORS INST NAT SANTE RECH MED (FR) 2004-02-11 EP claimed
US-7094773-B2 LTA4 hydrolase inhibitors Institut National de la Santa et de la rescherche Medicale Bioprojet (FR) 2006-08-22 US disclosed
US-6878723-B1 Carbocyclic and/or heterocyclic amino carboxylic acids, e.g., 2-aminomethyl-6-(p-benzylphenoxy)hexanoic acid; leukotriene A4 hydrolase; treating arthritis and psoriasis; hematoprotective and antimitotic agents INSTITUT NATIONAL DE LA SANTE ET DE LA RESCHERCHE MEDICALE (INSERM) (FR) 2005-04-12 US disclosed
US-20050027013-A1 LTA4 hydrolase inhibitors DANVY DENIS (FR) 2005-02-03 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-20050027013-A1 LTA4 hydrolase inhibitors LTA4H, LTC4S, LTB4R LTA4H 1/4885FFAR1 952/4885L3MBTL1 1543/4885

“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.