SCHEMBL9402187

SCHEMBL9402187

CCCCc1nnc(OCc2ccccc2)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.71

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 2/20 0.47
▸ AGTR2 P50052 2/20 0.47

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
SCHEMBL9873410 0.84 AGTR1 (0.50) AGTR1AGTR2
SCHEMBL9402500 0.83 AGTR1 (0.57) AGTR1
SCHEMBL9402478 0.83 AGTR1 (0.53) AGTR1
SCHEMBL9402357 0.83 AGTR1 (0.49) AGTR1
SCHEMBL7311106 0.83 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL13474406 0.82 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL8393708 0.82 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL3630129 0.82 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL7316455 0.82 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9402282 0.82 AGTR1 (0.49) 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-5336778-A Substituted triazoles as angiotensin II antagonists MERCK & CO., INC. (US) 1994-08-09 — — US disclosed
EP-0409332-A2 Substituted triazoles as angiotensin II antagonists MERCK & CO. INC. (US) 1991-01-23 — — EP disclosed
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