SCHEMBL4074378

SCHEMBL4074378

CCOc1ccc2ccccc2c1OC(=O)NC1N=C(c2ccccc2)c2ccccc2NC1=O

nearest known ligand 0.60

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 18/20 0.60
CCKAR P32238 14/20 0.60

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
SCHEMBL642001 0.87 CCKBR (0.66) CCKBRCCKAR
SCHEMBL642831 0.80 CCKBR (0.65) CCKBRCCKAR
SCHEMBL4072332 0.79 CCKBR (0.62) CCKBRCCKAR
SCHEMBL4071639 0.79 CCKBR (0.62) CCKBRCCKAR
SCHEMBL4420909 0.79 CCKBR (0.67) CCKBRCCKAR
SCHEMBL644213 0.79 CCKBR (0.70) CCKBRCCKAR
SCHEMBL644305 0.79 CCKBR (0.69) CCKBRCCKAR
SCHEMBL3966465 0.77 CCKBR (0.61) CCKBRCCKAR
SCHEMBL645104 0.75 CCKBR (0.62) CCKBRCCKAR
SCHEMBL642829 0.75 CCKBR (0.62) CCKBRCCKAR

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-1727550-B1 PHARMACEUTICAL COMPOSITION COMPRISING A BENZODIAZEPINE DERIVATIVE AND AN INHIBITOR OF THE RSV FUSION PROTEIN ARROW THERAPEUTICS LTD (GB) 2009-07-29 EP claimed