SCHEMBL7878437

SCHEMBL7878437

CCOC(=O)c1c(C(C)(C)O)nc(SC)n1Cc1ccc(-c2ccccc2-c2nnn[nH]2)cc1

nearest known ligand 0.58

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 8/20 0.47
AGTR2 P50052 7/20 0.47
ABCC3 O15438 1/20 0.47
ABCC4 O15439 1/20 0.47
ABCB11 O95342 1/20 0.47
CYP3A4 P08684 1/20 0.47
PDE4D Q08499 1/20 0.47
PDE3A Q14432 1/20 0.47
SLCO1B3 Q9NPD5 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
SLCO1B1 Q9Y6L6 1/20 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
SCHEMBL7886542 0.93 AGTR1 (0.46) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7878512 0.89 AGTR1 (0.53) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7885229 0.89 AGTR1 (0.51) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7886344 0.89 AGTR1 (0.53) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7308359 0.89 AGTR1 (0.53) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL18744748 0.89 AGTR1 (0.48) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7887962 0.87 AGTR1 (0.43) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL986792 0.87 AGTR1 (0.62) AGTR1AGTR2ABCC3ABCC4ABCB11
Hydrochloric Acid SCHEMBL7305266 0.86 AGTR1 (0.62) AGTR1AGTR2ABCC3ABCC4ABCB11
SCHEMBL7887632 0.86 AGTR1 (0.53) AGTR1AGTR2ABCC3ABCC4ABCB11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0573218-B1 4-Carboxyimidazoles as angiotensin II antagonists and their thrapeutic use SANKYO CO (JP) 2001-03-07 EP disclosed
US-5646171-A HYPOTENSIVE AGENTS SANKYO COMPANY, LIMITED (JP) 1997-07-08 US disclosed
US-5616599-A HYPOTENSIVE AGENTS FOR CARDIOVASCULAR DISORDER SANKYO COMPANY, LIMITED (JP) 1997-04-01 US disclosed
EP-0573218-A2 4-Carboxyimidazoles as angiotensin II antagonists and their thrapeutic use SANKYO COMPANY LIMITED (JP) 1993-12-08 EP disclosed