SCHEMBL3822799

SCHEMBL3822799

O=C(N[C@H]1N=C(c2ccccc2)c2ccccc2NC1=O)c1ccccc1N1CCS(=O)(=O)CC1

nearest known ligand 0.64

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ CCKBR P32239 7/20 0.64
▸ CCKAR P32238 7/20 0.62
▸ CBLB Q13191 13/20 0.61

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
SCHEMBL3823838 1.00 CCKBR (0.64) CCKBRCCKARCBLB
SCHEMBL3823284 0.91 CCKBR (0.61) CCKBRCCKARCBLB
SCHEMBL3823279 0.91 CCKBR (0.61) CCKBRCCKARCBLB
SCHEMBL3822253 0.90 CCKBR (0.56) CCKBRCCKARCBLB
SCHEMBL3822687 0.90 CCKBR (0.61) CCKBRCCKARCBLB
SCHEMBL3822685 0.90 CCKBR (0.61) CCKBRCCKARCBLB
SCHEMBL3823478 0.90 CCKBR (0.61) CCKBRCCKARCBLB
SCHEMBL3822256 0.90 CCKBR (0.56) CCKBRCCKARCBLB
SCHEMBL3824296 0.88 CBLB (0.75) CCKBRCCKARCBLB
SCHEMBL3825668 0.88 CCKBR (0.60) 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-1727551-B1 PHARMACEUTICAL COMPOSITION COMPRISING A BENZODIAZEPINE DERIVATIVE AND A INHIBITOR OF THE RSV FUSION PROTEIN ARROW THERAPEUTICS LTD (GB) 2009-09-09 — — EP claimed
Send feedback