SCHEMBL9571306

SCHEMBL9571306

CCCCc1nc2ccn(Cc3ccccc3C(=O)O)c(=O)c2n1Cc1ccc2oc(-c3ccccc3-c3nnn[nH]3)cc2c1

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 19/20 0.60
AGTR2 P50052 19/20 0.60

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
SCHEMBL9571288 0.91 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9571311 0.90 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9571389 0.88 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9571517 0.88 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL614372 0.87 AGTR1 (0.77) AGTR1AGTR2
SCHEMBL6555241 0.86 AGTR1 (0.69) AGTR1AGTR2
SCHEMBL9571615 0.85 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9571366 0.81 AGTR2 (0.54) AGTR1AGTR2
SCHEMBL9265644 0.80 AGTR1 (0.69) AGTR1AGTR2
SCHEMBL7942058 0.80 AGTR1 (0.78) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0546449-A2 Benzofuranderivatives as angiotensin II antagonists MERCK PATENT GmbH (DE) 1993-06-16 EP claimed
EP-0546449-A2 Benzofuranderivatives as angiotensin II antagonists MERCK PATENT GmbH (DE) 1993-06-16 EP disclosed