SCHEMBL8790132

SCHEMBL8790132

CCCCc1nc2ccc(NCS(=O)(=O)CCC)cc2n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 2/20 0.53
AGTR2 P50052 2/20 0.53

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
SCHEMBL8790323 0.91 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL8789393 0.91 AGTR1 (0.49) AGTR1AGTR2
SCHEMBL8790129 0.89 AGTR1 (0.67) AGTR1AGTR2
SCHEMBL8788790 0.88 PPARG (0.51) AGTR1AGTR2
SCHEMBL9040947 0.88 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9043513 0.88 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL9042708 0.86 AGTR1 (0.55) AGTR1AGTR2
SCHEMBL8789939 0.86 AGTR2 (0.55) AGTR1AGTR2
SCHEMBL9041655 0.86 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL9042467 0.86 AGTR1 (0.57) 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-0468470-B1 Benzimidazoles, medicaments containing them and process for their preparation THOMAE GMBH DR K (DE) 1997-04-16 EP disclosed
EP-0468470-A1 Benzimidazoles, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-01-29 EP disclosed