SCHEMBL8434040

SCHEMBL8434040

CCCCc1ncc(CC(S)C(=O)O)n1Cc1ccc(C(=O)O)cc1

nearest known ligand 0.66

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 3/20 0.65

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
SCHEMBL9386724 1.00 AGTR1 (0.65) AGTR1
SCHEMBL8954110 0.86 AGTR1 (0.61) AGTR1
SCHEMBL8954223 0.85 AGTR1 (0.62) AGTR1
SCHEMBL5547472 0.84 AGTR1 (0.72) AGTR1
SCHEMBL1258391 0.83 AGTR1 (0.68) AGTR1
SCHEMBL8957152 0.82 AGTR1 (0.61) AGTR1
SCHEMBL8954239 0.81 AGTR1 (0.58) AGTR1
SCHEMBL8438148 0.81 AGTR1 (0.63) AGTR1
SCHEMBL8954090 0.81 AGTR1 (0.57) AGTR1
SCHEMBL8954227 0.81 AGTR1 (0.57) AGTR1

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-5929249-A ANGIOTENSIN II RECEPTOR ANTAGONISTS SMITHKLINE BEECHAM CORPORATION (US) 1999-07-27 — — US disclosed
WO-1994000120-A1 CHEMICAL COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 1994-01-06 — — WO disclosed
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