SCHEMBL8858841

SCHEMBL8858841

CCCCc1nc(CO)c(SCC)n1Cc1ccc(-c2ccccc2C(=O)O)cc1

nearest known ligand 0.76

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.67
AGTR2 P50052 3/20 0.67

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
SCHEMBL8858851 0.91 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL8858881 0.90 AGTR1 (0.66) AGTR1AGTR2
SCHEMBL8823735 0.88 AGTR1 (0.54) AGTR1AGTR2
SCHEMBL7298585 0.86 AGTR1 (0.72) AGTR1AGTR2
SCHEMBL6534771 0.86 AGTR1 (0.75) AGTR1AGTR2
SCHEMBL9339135 0.86 AGTR1 (0.81) AGTR1AGTR2
SCHEMBL8858888 0.85 PPARG (0.52) AGTR1AGTR2
SCHEMBL7703476 0.85 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL7706792 0.84 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL7314316 0.84 AGTR1 (0.68) 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
US-5599830-A ANGIOTENSIN INHIBITORS ROUSSEL UCLAF (FR) 1997-02-04 US disclosed
US-5412101-A Angiotensin II inhibitor ROUSSEL-UCLAF (FR) 1995-05-02 US disclosed