SCHEMBL8553533

SCHEMBL8553533

CCCC(=O)N(Cc1ccc(-c2ccccc2-c2nc(=O)s[nH]2)cc1)c1sc(C)cc1C(=O)OC

nearest known ligand 0.45

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LTB4R2 Q9NPC1 18/20 0.45
AGTR1 P30556 2/20 0.36
AGTR2 P50052 1/20 0.36
BDKRB1 P46663 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
SCHEMBL8552462 0.91 LTB4R2 (0.49) LTB4R2AGTR1
SCHEMBL8550972 0.87 LTB4R2 (0.45) LTB4R2AGTR1AGTR2
SCHEMBL8547978 0.82 LTB4R2 (0.54) LTB4R2AGTR1
SCHEMBL8551883 0.80 LTB4R2 (0.49) LTB4R2AGTR1
SCHEMBL8553480 0.79 LTB4R2 (0.53) LTB4R2AGTR1AGTR2BDKRB1
SCHEMBL8551369 0.78 LTB4R2 (0.41) LTB4R2AGTR1AGTR2
SCHEMBL8549165 0.77 LTB4R2 (0.48) LTB4R2AGTR1
SCHEMBL8944293 0.77 LTB4R2 (0.48) LTB4R2AGTR1
SCHEMBL8550196 0.75 LTB4R2 (0.53) LTB4R2AGTR1
SCHEMBL8553682 0.75 LTB4R2 (0.49) LTB4R2AGTR1AGTR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0588299-B1 1,2,4-Oxadiazolyl- or 1,2,4-thiadiazolyl-biphenyl derivatives as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 1998-07-01 EP disclosed
EP-0829479-A1 Heterocyclic compounds and their use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1998-03-18 EP disclosed
US-5500427-A ANGIOTENSIN II ANTAGONISTS TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1996-03-19 US disclosed
EP-0588299-A2 1,2,4-Oxadiazolyl- or 1,2,4-thiadiazolyl-biphenyl derivatives as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) 1994-03-23 EP disclosed