SCHEMBL9842496

SCHEMBL9842496

CCCc1nn(CC(C)(C)C)c(COCc2ccccc2)c1Cc1ccc(-c2ccccc2-c2nnn(C(c3ccccc3)(c3ccccc3)c3ccccc3)n2)cc1

nearest known ligand 0.51

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
AGTR1 P30556 1/20 0.40

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
SCHEMBL9154513 0.93 AGTR1 (0.41) AGTR1
SCHEMBL9153924 0.90 AGTR1 (0.40) AGTR1
SCHEMBL9157041 0.88 AGTR1 (0.45) AGTR1
SCHEMBL9151144 0.88 AGTR1 (0.45) AGTR1
SCHEMBL9152249 0.88 AGTR1 (0.45) AGTR1
SCHEMBL9150379 0.87 AGTR1 (0.40) AGTR1
SCHEMBL9153032 0.87 AGTR1 (0.41) AGTR1
SCHEMBL9154125 0.86 AGTR1 (0.39) AGTR1
SCHEMBL9153348 0.86 AGTR1 (0.43) AGTR1
SCHEMBL9154324 0.84 AGTR1 (0.42) 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-0446062-A1 C-Linked pyrazole derivatives GLAXO GROUP LIMITED (GB) 1991-09-11 EP disclosed