SCHEMBL9402474

SCHEMBL9402474

CCCCc1nnc(SC)n1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.65

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PPARG P37231 2/20 0.55
▸ ACHE P22303 1/20 0.48

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
SCHEMBL9402495 0.86 AGTR1 (0.51) —
SCHEMBL9448503 0.85 PPARG (0.57) PPARGACHE
SCHEMBL9402340 0.83 PPARG (0.47) PPARGACHE
SCHEMBL9402197 0.82 ALDH1A1 (0.51) —
SCHEMBL9843750 0.79 PPARG (0.56) PPARGACHE
SCHEMBL9402357 0.79 AGTR1 (0.49) —
SCHEMBL3459616 0.78 PPARG (0.59) PPARGACHE
SCHEMBL9197325 0.78 PPARG (0.88) PPARG
SCHEMBL12716740 0.78 PPARG (0.61) PPARGACHE
SCHEMBL6430 0.78 PPARG (0.61) PPARGACHE

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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