SCHEMBL5325340

SCHEMBL5325340

COc1cc2c(cc1OC)N(c1ccc(NC(=O)C(N)C(C)C)cc1)C(=O)N(C1CC(C)(C)CC(C)(C)C1)N=C2C1CCCCC1

nearest known ligand 0.53

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 17/20 0.53
AAK1 Q2M2I8 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.33

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
SCHEMBL5327110 0.83 PTH1R (0.54) PTH1R
SCHEMBL5321537 0.80 PTH1R (0.73) PTH1R
SCHEMBL5324493 0.79 PTH1R (0.58) PTH1R
SCHEMBL5324433 0.79 PTH1R (0.74) PTH1R
SCHEMBL5322623 0.75 PTH1R (0.51) PTH1R
SCHEMBL5323824 0.74 PTH1R (0.49) PTH1R
SCHEMBL5322910 0.73 PTH1R (0.79) PTH1R
SCHEMBL5327303 0.72 PTH1R (0.39) PTH1R
SCHEMBL5320612 0.71 PTH1R (0.50) PTH1R
SCHEMBL5325603 0.71 PTH1R (0.48) PTH1R

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