SCHEMBL6607743

SCHEMBL6607743

CCOC(=O)c1cccnc1NC(CC)Cc1ccc(-c2ccccc2-c2nc(=O)o[nH]2)cc1

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.41
AGTR2 P50052 8/20 0.39
AGTR1 P30556 7/20 0.39
BDKRB1 P46663 4/20 0.37
PPIA P62937 1/20 0.36
PPARG P37231 1/20 0.36

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
SCHEMBL6607142 0.90 BRS3 (0.39) AGTR2AGTR1BDKRB1
SCHEMBL6607401 0.89 BDKRB1 (0.34) BDKRB1
SCHEMBL6610731 0.88 AGTR2 (0.51) AGTR2AGTR1
SCHEMBL6609722 0.85 HTT (0.41) HTTAGTR2AGTR1BDKRB1PPIA
SCHEMBL8548644 0.83 ALDH1A1 (0.36) HTTAGTR2AGTR1
SCHEMBL6606968 0.80 AGTR1 (0.47) AGTR2AGTR1
SCHEMBL6606053 0.79 AGTR1 (0.50) AGTR2AGTR1
SCHEMBL8548756 0.78 AGTR1 (0.37) AGTR2AGTR1
SCHEMBL9256897 0.77 HTT (0.41) HTTAGTR2AGTR1BDKRB1PPIA
SCHEMBL8944173 0.76 KDM4E (0.40) HTTAGTR2AGTR1PPARG

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