SCHEMBL6604865

SCHEMBL6604865

CCOC(=O)c1cccnc1CCCCc1ccc(-c2ccccc2C(=N)NO)cc1

nearest known ligand 0.43

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 7/20 0.43
AGTR2 P50052 7/20 0.43
HTT P42858 1/20 0.41
BDKRB1 P46663 4/20 0.40
KMT2A Q03164 1/20 0.39
BRS3 P32247 1/20 0.39

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
SCHEMBL6607280 0.78 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL28066682 0.76 TSHR (0.51) HTT
SCHEMBL16616136 0.76 TSHR (0.51) HTT
SCHEMBL7803641 0.75
SCHEMBL6417736 0.75 L3MBTL1 (0.56) HTTKMT2A
SCHEMBL6608757 0.73 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL8126448 0.72 TSHR (0.50) HTT
SCHEMBL17998734 0.72 AGTR2 (0.57) AGTR1AGTR2KMT2A
SCHEMBL8200687 0.72 TSHR (0.56) HTT
SCHEMBL9502624 0.71 FAAH (0.57) KMT2A

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