SCHEMBL8558028

SCHEMBL8558028

CC(C)CCN1C(=O)C(N(CCN(C)C)C(=O)Nc2ccccc2)C(=O)Nc2ccccc21

nearest known ligand 0.55

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 12/20 0.49

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
SCHEMBL8562206 0.80 CCKBR (0.44) CCKBR
SCHEMBL8559660 0.76 CCKBR (0.77) CCKBR
SCHEMBL8651647 0.71 CCKBR (0.85) CCKBR
SCHEMBL8557103 0.69 CCKBR (0.44) CCKBR
SCHEMBL8564471 0.69 CCKBR (0.63) CCKBR
SCHEMBL8558091 0.67 CCKBR (0.46) CCKBR
SCHEMBL8563276 0.67 CCKBR (0.50) CCKBR
SCHEMBL8648018 0.64 CCKBR (0.70) CCKBR
SCHEMBL8561057 0.62 P2RX7 (0.51) CCKBR
SCHEMBL8635376 0.62 CCKBR (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5716953-A MODIFIERS OF GASTRIN AND CHOLECYSTOKININS GLAXO WELLCOME S.P.A. (IT) 1998-02-10 US claimed
US-5716953-A MODIFIERS OF GASTRIN AND CHOLECYSTOKININS GLAXO WELLCOME S.P.A. (IT) 1998-02-10 US disclosed