SCHEMBL20867034

SCHEMBL20867034

N#Cc1ccc(C(=N)OC(=N)N[C@H]2N=C(c3ccccc3)c3ccccc3NC2=O)c(N2C3CCC2COC3)c1

nearest known ligand 0.51

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 9/20 0.51
▸ CBLB Q13191 9/20 0.43
▸ CCKAR P32238 7/20 0.42

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
SCHEMBL20867291 0.89 CCKBR (0.48) CCKBRCBLBCCKAR
SCHEMBL24611980 0.87 CCKBR (0.52) CCKBRCBLBCCKAR
SCHEMBL24611923 0.86 CCKBR (0.51) CCKBRCBLBCCKAR
SCHEMBL20867209 0.85 CBLB (0.55) CCKBRCBLBCCKAR
SCHEMBL20866735 0.85 CCKBR (0.51) CCKBRCBLBCCKAR
SCHEMBL20866646 0.83 CCKBR (0.49) CCKBRCBLBCCKAR
SCHEMBL24611973 0.83 CCKBR (0.61) CCKBRCCKAR
SCHEMBL20867130 0.82 CCKBR (0.47) CCKBRCBLBCCKAR
SCHEMBL24612084 0.81 CCKBR (0.55) CCKBRCCKAR
SCHEMBL20867207 0.80 CCKBR (0.47) CCKBRCBLBCCKAR

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
WO-2019067864-A1 COMBINATION PHARMACEUTICAL AGENTS AS RSV INHIBITORS ENANTA PHARMACEUTICALS, INC. (US) 2019-04-04 — — WO disclosed
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