SCHEMBL24611936

SCHEMBL24611936

N=C(NC1N=C(c2ccccc2)c2ccccc2NC1=O)OC(=N)c1ccccc1N1CCCC1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 8/20 0.53
▸ CCKAR P32238 7/20 0.53
▸ CBLB Q13191 10/20 0.51

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
SCHEMBL20867172 0.93 CBLB (0.56) CCKBRCCKARCBLB
SCHEMBL20866770 0.92 CCKAR (0.51) CCKBRCCKARCBLB
SCHEMBL20866674 0.92 CBLB (0.59) CCKBRCCKARCBLB
SCHEMBL24611909 0.92 CBLB (0.59) CCKBRCCKARCBLB
SCHEMBL20867007 0.92 CCKBR (0.50) CCKBRCCKARCBLB
SCHEMBL20866679 0.90 CBLB (0.51) CCKBRCCKARCBLB
SCHEMBL20867053 0.90 CBLB (0.53) CCKBRCCKARCBLB
SCHEMBL20866913 0.89 CCKBR (0.49) CCKBRCCKARCBLB
SCHEMBL20866962 0.88 CCKBR (0.49) CCKBRCCKARCBLB
SCHEMBL24611988 0.87 CBLB (0.51) CCKBRCCKARCBLB

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-3324977-B1 BENZODIAZEPINE DERIVATIVES AS RSV INHIBITORS ENANTA PHARM INC (US) 2022-07-13 — — EP disclosed
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