SCHEMBL9424433

SCHEMBL9424433

CCCCc1ncc(C=C(CC)C(=O)O)n1Cc1ccccc1Cl

nearest known ligand 0.87

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.75

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
Hydrochloric Acid SCHEMBL8954288 0.92 AGTR1 (0.73) AGTR1
Hydrochloric Acid SCHEMBL8954290 0.92 AGTR1 (0.73) AGTR1
SCHEMBL9424090 0.91
SCHEMBL9424094 0.91
SCHEMBL9424096 0.89 AGTR1 (0.68) AGTR1
SCHEMBL9424103 0.89 AGTR1 (0.68) AGTR1
SCHEMBL683468 0.88 AGTR1 (0.75) AGTR1
SCHEMBL6959201 0.88 AGTR1 (0.75) AGTR1
SCHEMBL10442003 0.88
SCHEMBL10442005 0.88

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
US-5312828-A Substituted imidazoles having angiotensin II receptor blocking activity SMITHKLINE BEECHAM CORPORATION A CORP. OF PENNSYLVANIA 1994-05-17 US disclosed