SCHEMBL7015019

SCHEMBL7015019

COC(=O)c1cccc([N+](=O)[O-])c1N(Cc1ccc(-c2ccccc2C(N)=O)cc1)C(=O)OC(C)(C)C

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 8/20 0.44
ALDH1A1 P00352 3/20 0.38
LMNA P02545 1/20 0.38
SMN1; SMN2 Q16637 1/20 0.38
MMP1 P03956 1/20 0.37
MMP9 P14780 1/20 0.37
MMP13 P45452 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
SLC6A3 Q01959 3/20 0.36
SLC6A4 P31645 2/20 0.36
BRS3 P32247 1/20 0.36
TP53 P04637 1/20 0.35
AGTR1 P30556 1/20 0.35
KMT2A Q03164 1/20 0.35
HPGD P15428 1/20 0.35

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
SCHEMBL4939408 0.87 LTB4R2 (0.41) LTB4R2ALDH1A1LMNASMN1; SMN2MMP1
SCHEMBL8566901 0.84 LTB4R2 (0.42) LTB4R2ALDH1A1LMNASMN1; SMN2MMP1
SCHEMBL8566898 0.82 LTB4R2 (0.39) LTB4R2ALDH1A1LMNASMN1; SMN2MAPT
SCHEMBL6849336 0.82 AGTR1 (0.39) LTB4R2ALDH1A1LMNASMN1; SMN2MMP1
SCHEMBL27488491 0.81 ALDH1A1 (0.36) LTB4R2ALDH1A1LMNASMN1; SMN2MMP1
SCHEMBL21065260 0.81 LTB4R2 (0.38) LTB4R2ALDH1A1LMNASMN1; SMN2MMP1
SCHEMBL12098821 0.80 ALDH1A1 (0.40) LTB4R2ALDH1A1LMNAMMP1MMP9
SCHEMBL7771116 0.79 LTB4R2 (0.42) LTB4R2ALDH1A1LMNABRS3AGTR1
SCHEMBL7480667 0.78 L3MBTL1 (0.47) ALDH1A1LMNASMN1; SMN2MMP1MMP9
SCHEMBL7009875 0.78 SLC6A3 (0.43) ALDH1A1LMNASMN1; SMN2MAPTMAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0520423-B1 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2003-05-14 EP disclosed
US-5883111-A STRONG AND LONG-LASTING ACTION BY ORAL ADMINISTRATION; HYPOTENSIVE AGENTS; CARDIOTONIC AGENTS; ALZHEIMER'S DISEASE; TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1999-03-16 US disclosed
US-5736555-A HYPOTENSIVE AGENTS; FDA ORANGE BOOK LISTED PATENT FOR AZILSARTAN MEDOXOMIL TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-04-07 US disclosed
US-5583141-A ADMINISTERING AS THERAPEUTIC AGENTS OF CIRCULATORY DISEASES; AZILSARTAN; ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-12-10 US disclosed
US-5354766-A 2-Ethoxy-1-((2'(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl) biphenyl-4-yl)methyl)benzimidazole-7-carboxylic acid; hypotensive agents; CNS activity TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-10-11 US disclosed
US-5243054-A Hypotensive agents, cardiovascular disorders or nervous system disorders TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1993-09-07 US disclosed
EP-0520423-A2 Heterocyclic compounds, their production and use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1992-12-30 EP disclosed