SCHEMBL8809199

SCHEMBL8809199

CC(C)N(C(=O)CN1C(=O)C(CC=Cc2ccccc2)C(=O)N(c2ccccc2)c2ccccc21)c1ccccc1

nearest known ligand 0.67

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
CCKAR P32238 18/20 0.66
CCKBR P32239 17/20 0.66

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
SCHEMBL8804000 0.88 CCKAR (0.69) CCKARCCKBR
SCHEMBL7550570 0.80 CCKAR (0.67) CCKARCCKBR
SCHEMBL8813458 0.79 CCKAR (0.68) CCKARCCKBR
SCHEMBL7752992 0.79 CCKAR (0.65) CCKARCCKBR
SCHEMBL8806380 0.78 CCKAR (0.71) CCKARCCKBR
SCHEMBL8805140 0.76 CCKAR (0.74) CCKARCCKBR
SCHEMBL8806176 0.75 CCKAR (0.61) CCKARCCKBR
SCHEMBL7747691 0.74 CCKBR (1.00) CCKARCCKBR
SCHEMBL8807834 0.74 CCKAR (0.58) CCKARCCKBR
SCHEMBL8804820 0.74 CCKAR (0.66) CCKARCCKBR

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
EP-0755384-A1 CCK OR GASTRIN MODULATING 1,5 BENZODIAZEPINES DERIVATIVES GLAXO WELLCOME INC. (US) 1997-01-29 EP disclosed
WO-1995028391-A1 CCK OR GASTRIN MODULATING 1,5 BENZODIAZEPINES DERIVATIVES GLAXO WELLCOME INC. (US) 1995-10-26 WO disclosed