SCHEMBL9846759

SCHEMBL9846759

CCCCc1nc(Cl)c(CO)n1Cc1ccc2c(c1)cc(-c1ccccc1C#N)n2C(=O)OC(C)(C)C

nearest known ligand 0.51

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
AGTR2 P50052 4/20 0.51
AGTR1 P30556 3/20 0.51

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
SCHEMBL541 0.79 AGTR1 (0.69) AGTR2AGTR1
SCHEMBL9846706 0.77 AGTR1 (0.54) AGTR2AGTR1
SCHEMBL9860045 0.76 AGTR1 (0.54) AGTR2AGTR1
SCHEMBL9428704 0.76 AGTR1 (0.56) AGTR2AGTR1
SCHEMBL9846741 0.76 AGTR2 (0.52) AGTR2AGTR1
SCHEMBL27451816 0.76 AGTR1 (0.53) AGTR2AGTR1
SCHEMBL7177667 0.75 AGTR1 (0.63) AGTR2AGTR1
SCHEMBL9846777 0.75 AGTR2 (0.55) AGTR2AGTR1
SCHEMBL9309503 0.75 AGTR1 (0.50) AGTR2AGTR1
SCHEMBL9309742 0.74 AGTR1 (0.51) AGTR2AGTR1

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-0429257-A2 Indole derivatives GLAXO GROUP LIMITED (GB) 1991-05-29 EP disclosed