SCHEMBL8564644

SCHEMBL8564644

NC1C(=O)N(CCN2CCOCC2)c2ccccc2N(CC23CC4CC(CC(C4)C2)C3)C1=O

nearest known ligand 0.66

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CCKBR P32239 9/20 0.49
KDM4E B2RXH2 2/20 0.46
EPHX2 P34913 1/20 0.42
KDM1A O60341 1/20 0.41
MAPT P10636 1/20 0.41

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
SCHEMBL8557455 0.91 CCKBR (0.47) CCKBREPHX2
SCHEMBL8558176 0.88 MEN1 (0.46) CCKBRKDM4EEPHX2
SCHEMBL8562940 0.83 KDM4E (0.47) CCKBRKDM4EEPHX2KDM1AMAPT
SCHEMBL8866156 0.82 CCKBR (0.53) CCKBREPHX2
SCHEMBL8866731 0.81 CCKBR (0.51) CCKBREPHX2
SCHEMBL7926069 0.80 CCKBR (0.79) CCKBR
SCHEMBL8866621 0.80 CCKBR (0.64) CCKBREPHX2
SCHEMBL8650316 0.78 CCKBR (0.47) CCKBR
SCHEMBL8563447 0.77 KDM1A (0.45) CCKBRKDM4EKDM1AMAPT
SCHEMBL8621950 0.77 CCKBR (0.61) CCKBREPHX2

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