SCHEMBL7308446

SCHEMBL7308446

CCCc1nc(SC)nc(O)c1Cc1ccc(-c2ccccc2C#N)cc1

nearest known ligand 0.47

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PPARG P37231 2/20 0.47
AGTR1 P30556 2/20 0.41
AGTR2 P50052 2/20 0.41
ESR2 Q92731 1/20 0.40
APLNR P35414 1/20 0.37
ACHE P22303 1/20 0.36

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
SCHEMBL9309532 0.88 PPARG (0.47) PPARGAGTR1AGTR2ACHE
SCHEMBL9311025 0.86 PPARG (0.49) PPARGAGTR1AGTR2ESR2APLNR
SCHEMBL9307715 0.86 PPARG (0.49) PPARGAGTR1AGTR2ESR2
SCHEMBL9309735 0.85 PPARG (0.48) PPARGAGTR1AGTR2ESR2APLNR
SCHEMBL8312740 0.85 PPARG (0.48) PPARGAGTR1AGTR2ESR2
SCHEMBL9308652 0.85 PPARG (0.43) PPARGAGTR1AGTR2ACHE
SCHEMBL7312142 0.83 PPARG (0.46) PPARGAGTR1AGTR2ESR2APLNR
SCHEMBL9308255 0.82 PPARG (0.46) PPARGAGTR1AGTR2ESR2APLNR
SCHEMBL9308863 0.82 PPARG (0.46) PPARGESR2ACHE
SCHEMBL9846024 0.82 PPARG (0.47) PPARGAGTR1AGTR2ESR2APLNR

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628046-B1 TRIAZOLOPYRIMIDIN DERIVATIVES AS ANTIOTENSIN II RECEPTOR ANTAGONISTS UNION PHARMA SCIENT APPL (FR) 1999-05-12 EP disclosed
US-5387747-A Used in the treatment and prevention of cardiovascular diseases: hypertension, cardiac insufficiency and atherosclerosis LABORATOIRES UPSA (FR) 1995-02-07 US disclosed
EP-0628046-A1 TRIAZOLOPYRIMIDIN DERIVATIVES AS ANTIOTENSIN II RECEPTOR ANTAGONISTS LABORATOIRES UPSA (FR) 1994-12-14 EP disclosed
US-5358950-A Useful in treatment of cardiovascular diseases LABORATOIRES UPSA (FR) 1994-10-25 US disclosed
WO-1993017024-A1 TRIAZOLOPYRIMIDIN DERIVATIVES AS ANTIOTENSIN II RECEPTOR ANTAGONISTS LABORATOIRES UPSA (FR) 1993-09-02 WO disclosed
US-5231094-A Cardiovascular disorders SOCIETE ANONYME: LABORATOIRES UPSA (FR) 1993-07-27 US disclosed