SCHEMBL20866772

SCHEMBL20866772

N=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)OC(=N)c1cc(C(F)(F)F)cnc1N1CCOCC1

nearest known ligand 0.49

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 15/20 0.49
▸ CCKAR P32238 5/20 0.49
▸ CCKBR P32239 3/20 0.49

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
SCHEMBL20866828 0.91 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL20867088 0.89 CCKAR (0.50) CBLBCCKARCCKBR
SCHEMBL20867031 0.89 CCKAR (0.50) CBLBCCKARCCKBR
SCHEMBL24611939 0.87 CBLB (0.49) CBLBCCKARCCKBR
SCHEMBL20866745 0.87 CCKAR (0.53) CBLBCCKARCCKBR
SCHEMBL20867009 0.86 CBLB (0.56) CBLBCCKARCCKBR
SCHEMBL20866611 0.86 CBLB (0.56) CBLBCCKARCCKBR
SCHEMBL20866620 0.86 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL24611935 0.84 CBLB (0.51) CBLBCCKARCCKBR
SCHEMBL24612255 0.84 CBLB (0.51) CBLBCCKARCCKBR

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
Send feedback