SCHEMBL7706072

SCHEMBL7706072

CCCCc1nc(SCC)c(CO)n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 3/20 0.57
AGTR2 P50052 3/20 0.57

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
SCHEMBL6566415 0.87 AGTR2 (0.74) AGTR1AGTR2
SCHEMBL7703476 0.86 AGTR1 (0.76) AGTR1AGTR2
SCHEMBL8858880 0.84 AGTR2 (0.61) AGTR1AGTR2
SCHEMBL9041377 0.81 AGTR1 (0.74) AGTR1AGTR2
SCHEMBL7709126 0.80 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9042669 0.79 AGTR1 (0.58) AGTR1AGTR2
SCHEMBL9041185 0.79 PPARG (0.60) AGTR1AGTR2
SCHEMBL9042978 0.79 PPARG (0.60) AGTR1AGTR2
SCHEMBL9042283 0.78 AGTR1 (0.62) AGTR1AGTR2
SCHEMBL9704879 0.78 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-0644188-B1 Process for the preparation of sulfur derivatives of imidazole and intermediates obtained AVENTIS PHARMA SA (FR) 2002-12-04 EP claimed
EP-0648763-B1 Process for the preparation of sulfur derivatives of imidazole and intermediates obtained AVENTIS PHARMA SA (FR) 2001-05-09 EP claimed