SCHEMBL5323921

SCHEMBL5323921

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

nearest known ligand 0.35

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PTH1R Q03431 16/20 0.35
CCKBR P32239 1/20 0.31
ANPEP P15144 1/20 0.30
DPP4 P27487 1/20 0.30
EGLN1 Q9GZT9 1/20 0.30

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 0.84 PTH1R (0.54) PTH1RCCKBR
SCHEMBL5320612 0.82 PTH1R (0.50) PTH1R
SCHEMBL5324381 0.80 PTH1R (0.60) PTH1R
SCHEMBL5325603 0.80 PTH1R (0.48) PTH1R
SCHEMBL5326595 0.79 PTH1R (0.47) PTH1RCCKBR
SCHEMBL5322987 0.78 PTH1R (0.42) PTH1R
SCHEMBL5323824 0.78 PTH1R (0.49) PTH1R
SCHEMBL5324138 0.76 PTH1R (0.45) PTH1RCCKBR
SCHEMBL5326214 0.76 DAO (0.34) PTH1RCCKBR
SCHEMBL5322623 0.74 PTH1R (0.51) PTH1RCCKBR

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