SCHEMBL5327110

SCHEMBL5327110

Cc1cccc2c1N(c1ccc(NC(=O)C(N)C(C)C)cc1)C(=O)N(C1CC(C)(C)CC(C)(C)C1)N=C2C1CCCCC1

nearest known ligand 0.54

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 10/20 0.54
CCKBR P32239 9/20 0.32
GRM1 Q13255 1/20 0.31
GRM4 Q14833 1/20 0.31
CCKAR P32238 1/20 0.31

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
SCHEMBL5323921 0.84 PTH1R (0.35) PTH1RCCKBR
SCHEMBL5325340 0.83 PTH1R (0.53) PTH1R
SCHEMBL5324433 0.80 PTH1R (0.74) PTH1RCCKBR
SCHEMBL5324381 0.77 PTH1R (0.60) PTH1R
SCHEMBL5321537 0.76 PTH1R (0.73) PTH1R
SCHEMBL5324493 0.76 PTH1R (0.58) PTH1RCCKBR
SCHEMBL5322623 0.76 PTH1R (0.51) PTH1RCCKBR
SCHEMBL5325329 0.72 PTH1R (0.81) PTH1RCCKBRCCKAR
SCHEMBL5322910 0.71 PTH1R (0.79) PTH1R
SCHEMBL5333234 0.70 PTH1R (0.74) PTH1RCCKBRCCKAR

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
WO-2006129120-A9 BENZOTRIAZEPINONE DERIVATIVES JAMES BLACK FOUNDATION (GB) 2007-03-22 WO disclosed
WO-2006129120-A2 BENZOTRIAZEPINONE DERIVATIVES JAMES BLACK FOUNDATION (GB) 2006-12-07 WO disclosed