SCHEMBL7418128

SCHEMBL7418128

CCCCc1nc(Cl)c(C(=O)OCC)n1Cc1ccc(C2(C(=O)OCC)CC=CC2)s1

nearest known ligand 0.41

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 4/20 0.38
AGTR2 P50052 4/20 0.38

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
SCHEMBL7415863 0.84 AGTR1 (0.38) AGTR1AGTR2
SCHEMBL241111 0.83 AGTR2 (0.43) AGTR1AGTR2
SCHEMBL7419267 0.82 AGTR1 (0.37) AGTR1AGTR2
SCHEMBL7423304 0.79 PDE4A (0.38) AGTR1AGTR2
SCHEMBL243577 0.77 AGTR2 (0.37) AGTR1AGTR2
SCHEMBL7422043 0.74 AGTR1 (0.40) AGTR1
SCHEMBL7427913 0.74 AGTR1 (0.44) AGTR1AGTR2
SCHEMBL8700912 0.73
SCHEMBL7423678 0.73
SCHEMBL8701089 0.73 OPRM1 (0.31)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1995002596-A1 AZACYCLIC-HETEROCYCLIC COMPOUNDS AS ANGIOTENSIN II RECEPTOR ANTAGONISTS PFIZER INC. (US) 1995-01-26 WO disclosed