SCHEMBL8565506

SCHEMBL8565506

CCCCc1nc(Cl)c(C(=O)O)n1Cc1ccc(-c2ccccc2I)cc1

nearest known ligand 0.80

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 4/20 0.69
AGTR1 P30556 3/20 0.69

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
SCHEMBL8564634 0.89 AGTR2 (0.57) AGTR2AGTR1
SCHEMBL708 0.89 AGTR1 (0.80) AGTR2AGTR1
SCHEMBL9468705 0.88 AGTR1 (0.78) AGTR2AGTR1
SCHEMBL9483479 0.84 AGTR2 (0.76) AGTR2AGTR1
SCHEMBL29308427 0.84 AGTR2 (0.65) AGTR2AGTR1
SCHEMBL8565334 0.84 AGTR1 (0.73) AGTR2AGTR1
SCHEMBL8564639 0.84 AGTR2 (0.67) AGTR2AGTR1
SCHEMBL21083640 0.83 AGTR2 (0.66) AGTR2AGTR1
SCHEMBL29726833 0.83 AGTR2 (0.66) AGTR2AGTR1
SCHEMBL29308428 0.83 AGTR2 (0.64) AGTR2AGTR1

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0649424-B1 DIOXCYCLOBUTENE DERIVATIVES AS ANGIOTENSIN II ANTAGONISTS KNOLL AG (DE) 1998-10-07 EP disclosed
US-5627191-A Therapeutic agents THE BOOTS COMPANY PLC (GB) 1997-05-06 US disclosed
EP-0649424-A1 DIOXCYCLOBUTENE DERIVATIVES AS ANGIOTENSIN II ANTAGONISTS Knoll AG (DE) 1995-04-26 EP disclosed
WO-1994001436-A1 DIOXCYCLOBUTENE DERIVATIVES AS ANGIOTENSIN II ANTAGONISTS THE BOOTS COMPANY PLC (GB) 1994-01-20 WO disclosed