SCHEMBL8558932

SCHEMBL8558932

COC(=O)c1cccc(N(C(N)=O)C2CC(c3ccccc3OC)CC(c3ccccc3)N(CC(=O)NC(C)(C)C)C2=O)c1

nearest known ligand 0.57

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 20/20 0.57

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
SCHEMBL8558934 1.00 CCKBR (0.57) CCKBR
SCHEMBL8398547 0.95 CCKBR (0.58) CCKBR
SCHEMBL8912174 0.95 CCKBR (0.58) CCKBR
SCHEMBL8398544 0.95 CCKBR (0.58) CCKBR
SCHEMBL8402213 0.92 CCKBR (0.55) CCKBR
SCHEMBL8399447 0.92 CCKBR (0.55) CCKBR
SCHEMBL8912667 0.92 CCKBR (0.55) CCKBR
SCHEMBL8914538 0.86 CCKBR (0.53) CCKBR
SCHEMBL8401039 0.85 CCKBR (0.57) CCKBR
SCHEMBL8401037 0.85 CCKBR (0.57) CCKBR

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-0711283-B1 TETRAHYDRO-1H-BENZAZEPINONES AND HEXAHYDROAZEPINONES AS SELECTIVE CHOLECYSTOKININ-B RECEPTOR ANTAGONISTS PFIZER (US) 1999-06-16 EP disclosed