SCHEMBL18508875

SCHEMBL18508875

CCCC(C)(C)OC(=O)N(Cc1ccc2c(Br)nn(CCCOC)c2c1)C1CC1

nearest known ligand 0.42

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ REN P00797 17/20 0.42
▸ ITK Q08881 3/20 0.37

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
SCHEMBL13132274 0.91 REN (0.41) RENITK
SCHEMBL18508876 0.90 REN (0.41) RENITK
SCHEMBL2808527 0.86 REN (0.46) RENITK
SCHEMBL2810132 0.80 REN (0.41) RENITK
SCHEMBL13132302 0.79 REN (0.40) RENITK
SCHEMBL2834678 0.79 REN (0.49) REN
SCHEMBL2835897 0.78 REN (0.39) RENITK
SCHEMBL13132277 0.78 REN (0.46) REN
SCHEMBL13132300 0.76 REN (0.40) REN
SCHEMBL13131552 0.76 REN (0.69) REN

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-2168952-B1 MORPHOLINE DERIVATIVES AS RENIN INHIBITORS MITSUBISHI TANABE PHARMA CORP (JP) 2017-02-15 — — EP disclosed
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