SCHEMBL9704749

SCHEMBL9704749

CCCCc1nc2ccc(NS(=O)(=O)c3ccc(Cl)cc3)nc2n1Cc1ccc(-c2ccccc2OC(=O)O)cc1

nearest known ligand 0.50

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 2/20 0.50
EDNRA P25101 1/20 0.45

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
SCHEMBL9704787 0.91 AGTR2 (0.46) AGTR2EDNRA
SCHEMBL9704405 0.89 AGTR1 (0.48) AGTR2
SCHEMBL9704681 0.89 AGTR1 (0.48) AGTR2
SCHEMBL9705964 0.88 AGTR1 (0.47) AGTR2
SCHEMBL9704858 0.87 AGTR1 (0.47) AGTR2
SCHEMBL9704369 0.87 PPARG (0.47) AGTR2
SCHEMBL9704116 0.86 AGTR1 (0.51) AGTR2
SCHEMBL9705252 0.85 AGTR1 (0.51) AGTR2
SCHEMBL9705955 0.85 AGTR2 (0.48) AGTR2
SCHEMBL9704743 0.84 AGTR1 (0.50) AGTR2

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-0470543-A1 Heterocyclic imidazoles, remedies containing them and processes for their preparation Dr. Karl Thomae GmbH (DE) 1992-02-12 EP disclosed