SCHEMBL9033249

SCHEMBL9033249

CCCCc1nn(-c2ccccc2C(=O)NC)c(=O)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.63

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ AGTR1 P30556 1/20 0.52
▸ AGTR2 P50052 1/20 0.52

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
SCHEMBL9034260 0.91 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL9033418 0.91 — —
SCHEMBL9033733 0.87 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL9031470 0.86 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9031911 0.86 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9031930 0.86 — —
SCHEMBL9033266 0.86 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9034298 0.86 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL9033001 0.86 AGTR1 (0.56) AGTR1AGTR2
SCHEMBL9030401 0.85 AGTR1 (0.55) 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
EP-0412594-B1 Substituted triazolinones, triazolinethiones, and triazolinimines as angiotensin II antagonists MERCK & CO INC (US) 1996-01-03 — — EP disclosed
EP-0412594-A2 Substituted triazolinones, triazolinethiones, and triazolinimines as angiotensin II antagonists MERCK & CO. INC. (US) 1991-02-13 — — EP disclosed
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