SCHEMBL9402464

SCHEMBL9402464

CCCCc1nnc(S(=O)(=O)Cc2ccc(Cl)cc2)n1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.70

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.48
▸ ACHE P22303 1/20 0.47
▸ AGTR1 P30556 2/20 0.42
▸ AGTR2 P50052 1/20 0.42

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
SCHEMBL9402199 0.82 AGTR1 (0.47) AGTR1AGTR2
SCHEMBL9402495 0.80 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL9448503 0.79 PPARG (0.57) PPARGACHEAGTR1AGTR2
SCHEMBL9402474 0.77 PPARG (0.55) PPARGACHE
SCHEMBL9402289 0.76 AGTR1 (0.41) AGTR1AGTR2
SCHEMBL3459616 0.74 PPARG (0.59) PPARGACHEAGTR1AGTR2
SCHEMBL9198282 0.74 PPARG (0.70) PPARGAGTR1AGTR2
SCHEMBL9194096 0.74 PPARG (0.70) PPARGAGTR1AGTR2
SCHEMBL12716740 0.74 PPARG (0.61) PPARGACHEAGTR1AGTR2
SCHEMBL6430 0.74 PPARG (0.61) PPARGACHEAGTR1AGTR2

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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