SCHEMBL9859403

SCHEMBL9859403

CCc1nc(C)c(C(=O)NC)n1Cc1c2ccocc-2c(Br)c1-c1ccccc1-c1nnn(C(c2ccccc2)(c2ccccc2)c2ccccc2)n1

nearest known ligand 0.41

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.32

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
SCHEMBL9695399 0.93 AGTR1 (0.33) AGTR1
SCHEMBL9695385 0.91 ALDH1A1 (0.32) AGTR1
SCHEMBL9310048 0.88 AGTR1 (0.31) AGTR1
SCHEMBL9310700 0.88 AGTR1 (0.31) AGTR1
SCHEMBL9860046 0.88 AGTR1 (0.35) AGTR1
SCHEMBL9311410 0.87 AGTR1 (0.36) AGTR1
SCHEMBL9309386 0.87 AGTR1 (0.38) AGTR1
SCHEMBL9318953 0.87 AGTR1 (0.32) AGTR1
SCHEMBL9311209 0.86 AGTR1 (0.31) AGTR1
SCHEMBL9694922 0.86 AGTR1 (0.39) AGTR1

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-0434249-A2 Benzofuran derivatives GLAXO GROUP LIMITED (GB) 1991-06-26 EP disclosed