SCHEMBL20866781

SCHEMBL20866781

N=C(NC1N=C(C2=CC=CCC2)c2cccc(F)c2NC1=O)OC(=N)c1ccccc1N1CCOCC1

nearest known ligand 0.34

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ CBLB Q13191 11/20 0.34
▸ NOTCH1 P46531 3/20 0.34
▸ RBPJ Q06330 3/20 0.34
▸ CCKBR P32239 4/20 0.32
▸ GAA P10253 1/20 0.31
▸ ALOX15 P16050 1/20 0.31
▸ MAPK1 P28482 1/20 0.31
▸ CCKAR P32238 1/20 0.30

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
SCHEMBL20867288 0.87 CBLB (0.46) CBLBNOTCH1RBPJCCKBRCCKAR
SCHEMBL20866780 0.87 CBLB (0.46) CBLBNOTCH1RBPJCCKBRCCKAR
SCHEMBL20866656 0.83 CCKBR (0.38) CBLBCCKBRCCKAR
SCHEMBL20867202 0.78 CBLB (0.46) CBLBNOTCH1RBPJCCKBRCCKAR
SCHEMBL24612224 0.78 CBLB (0.44) CBLBNOTCH1RBPJCCKBRCCKAR
SCHEMBL20866688 0.76 NOTCH1 (0.43) CBLBNOTCH1RBPJCCKBRCCKAR
SCHEMBL20866674 0.76 CBLB (0.59) CBLBCCKBRCCKAR
SCHEMBL24611909 0.76 CBLB (0.59) CBLBCCKBRCCKAR
SCHEMBL20866783 0.73 NOTCH1 (0.42) CBLBNOTCH1RBPJCCKBRCCKAR
SCHEMBL20866782 0.73 NOTCH1 (0.42) CBLBNOTCH1RBPJCCKBRCCKAR

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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