SCHEMBL6610008

SCHEMBL6610008

CCOC(=O)c1cn(C)nc1NC(CC)Cc1ccc(-c2ccccc2C(=N)NOC(=O)OC)cc1

nearest known ligand 0.39

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 6/20 0.39
JMJD6 Q6NYC1 1/20 0.37
LTB4R2 Q9NPC1 1/20 0.35
TP53 P04637 1/20 0.35
AGTR2 P50052 4/20 0.34
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
MME P08473 1/20 0.33

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
SCHEMBL8944158 0.91 JMJD6 (0.39) AGTR1JMJD6TP53AGTR2
SCHEMBL6610015 0.78 AGTR1 (0.53) AGTR1LTB4R2AGTR2
SCHEMBL8551396 0.77 AGTR1 (0.38) AGTR1JMJD6TP53AGTR2NPC1
SCHEMBL8944331 0.75 AGTR1 (0.51) AGTR1AGTR2NPC1RAB9AMME
SCHEMBL8944450 0.75 LMNA (0.39) AGTR1TP53AGTR2NPC1RAB9A
SCHEMBL8944447 0.74 AGTR1 (0.36) AGTR1LTB4R2TP53AGTR2MME
SCHEMBL8548779 0.68 LTB4R2 (0.48) AGTR1JMJD6LTB4R2AGTR2
SCHEMBL8548756 0.68 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL8553680 0.68 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL8944162 0.67 AGTR1 (0.54) AGTR1AGTR2

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
EP-0829479-B1 Heterocyclic compounds and their use as angiotensin II antagonists TAKEDA CHEMICAL INDUSTRIES LTD (JP) 2004-04-14 EP disclosed
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