SCHEMBL14180366

SCHEMBL14180366

Cc1ccc(NC(=O)NC2N=C(c3ccccc3)c3ccccc3N(C)C2=O)cc1Cl

nearest known ligand 0.86

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.86
KCNH2 Q12809 1/20 0.75

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
SCHEMBL14180430 0.93 CCKBR (0.74) CCKBRKCNH2
SCHEMBL9866255 0.93 CCKBR (1.00) CCKBRKCNH2
SCHEMBL9865032 0.88 CCKBR (1.00) CCKBR
SCHEMBL9865023 0.88 CCKBR (1.00) CCKBR
SCHEMBL9842500 0.87 CCKBR (1.00) CCKBRKCNH2
SCHEMBL9842493 0.87 CCKBR (1.00) CCKBRKCNH2
SCHEMBL9866668 0.87 CCKBR (1.00) CCKBRKCNH2
SCHEMBL9865992 0.87 CCKBR (1.00) CCKBRKCNH2
SCHEMBL9867468 0.87 CCKBR (1.00) CCKBRKCNH2
SCHEMBL14180370 0.86 CCKBR (0.80) CCKBRKCNH2

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7375101-B2 Benzodiazepine derivatives, preparation thereof and use thereof ASTRAZENECA AB (SE) 2008-05-20 US disclosed
US-7375101-B2 Benzodiazepine derivatives, preparation thereof and use thereof ASTRAZENECA AB (SE) 2008-05-20 US disclosed