SCHEMBL7314455

SCHEMBL7314455

CCCCc1nc2c(C)cc(NCS(=O)(=O)Cc3ccccc3)cc2n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.54

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 16/20 0.54
AGTR2 P50052 9/20 0.54

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
SCHEMBL7307960 0.92 AGTR1 (0.51) AGTR1AGTR2
SCHEMBL7312165 0.86 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL7306236 0.84 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL7305602 0.84 AGTR1 (0.59) AGTR1AGTR2
SCHEMBL7305560 0.83 AGTR1 (0.60) AGTR1AGTR2
SCHEMBL8790132 0.82 AGTR1 (0.53) AGTR1AGTR2
SCHEMBL7311426 0.82 AGTR1 (0.46) AGTR1AGTR2
SCHEMBL7314732 0.82 AGTR1 (0.61) AGTR1AGTR2
SCHEMBL7304967 0.82 AGTR1 (0.57) AGTR1AGTR2
SCHEMBL7300288 0.81 AGTR1 (0.59) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0502314-A1 Benzimidazol, medicaments containing them and process for their preparation Dr. Karl Thomae GmbH (DE) 1992-09-09 EP disclosed