SCHEMBL20867239

SCHEMBL20867239

N=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)OC(=N)c1oc2cccc(F)c2c1N1CCOCC1

nearest known ligand 0.48

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 9/20 0.48
▸ CCKBR P32239 8/20 0.46
▸ CCKAR P32238 7/20 0.46
▸ NOTCH1 P46531 1/20 0.42
▸ RBPJ Q06330 1/20 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
SCHEMBL20866836 0.90 CBLB (0.51) CBLBCCKBRCCKAR
SCHEMBL20866793 0.90 CBLB (0.51) CBLBCCKBRCCKAR
SCHEMBL20867282 0.88 CBLB (0.56) CBLBCCKBRCCKAR
SCHEMBL24612041 0.87 CBLB (0.47) CBLBCCKBRCCKARNOTCH1RBPJ
SCHEMBL20866849 0.87 CBLB (0.47) CBLBCCKBRCCKARNOTCH1RBPJ
SCHEMBL20867243 0.83 CBLB (0.48) CBLBCCKBRCCKAR
SCHEMBL20867052 0.81 CBLB (0.53) CBLBCCKBRCCKAR
SCHEMBL20867054 0.81 CBLB (0.53) CBLBCCKBRCCKAR
SCHEMBL24611926 0.81 CBLB (0.53) CBLBCCKBRCCKAR
SCHEMBL24611894 0.81 CBLB (0.55) CBLBCCKBRCCKAR

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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