SCHEMBL6606486

SCHEMBL6606486

CCCn1oc(=O)nc1-c1ccccc1-c1ccc(CNc2ncccc2C(=O)OCC)cc1

nearest known ligand 0.48

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
BDKRB1 P46663 9/20 0.48
AGTR1 P30556 7/20 0.47
AGTR2 P50052 7/20 0.47
KDR P35968 1/20 0.43
HTT P42858 1/20 0.43
RAB9A P51151 1/20 0.42
NPSR1 Q6W5P4 1/20 0.42
MAPT P10636 1/20 0.41

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
SCHEMBL6607228 0.84 AGTR1 (0.61) BDKRB1AGTR1AGTR2HTTRAB9A
SCHEMBL6607576 0.76 AGTR1 (0.47) BDKRB1AGTR1AGTR2MAPT
SCHEMBL2087990 0.76 HTT (0.65) KDRHTTRAB9ANPSR1MAPT
SCHEMBL6605088 0.76 AGTR1 (0.55) AGTR1AGTR2MAPT
SCHEMBL4174847 0.73 MAPT (0.56) KDRHTTRAB9ANPSR1MAPT
SCHEMBL28236466 0.73 KDR (0.62) KDRHTTRAB9ANPSR1MAPT
SCHEMBL2087947 0.71 HTT (0.56) BDKRB1KDRHTTRAB9ANPSR1
SCHEMBL9438606 0.71 SLC33A1 (0.37) AGTR1AGTR2MAPT
SCHEMBL4171211 0.69 HTT (0.52) KDRHTTRAB9ANPSR1MAPT
SCHEMBL6612663 0.68 ALDH1A1 (0.68) HTTRAB9ANPSR1MAPT

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