SCHEMBL8562940

SCHEMBL8562940

O=C1[C]C(=O)N(CC23CC4CC(CC(C4)C2)C3)c2ccccc2N1CCN1CCOCC1

nearest known ligand 0.59

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.47
CCKBR P32239 5/20 0.46
EPHX2 P34913 3/20 0.43
KDM1A O60341 1/20 0.42
MAPT P10636 1/20 0.42
CNR2 P34972 2/20 0.39

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
SCHEMBL8564644 0.83 CCKBR (0.49) KDM4ECCKBREPHX2KDM1AMAPT
SCHEMBL7926069 0.74 CCKBR (0.79) CCKBR
SCHEMBL8557455 0.74 CCKBR (0.47) CCKBREPHX2
SCHEMBL14072264 0.72 EPHX2 (0.56) CCKBREPHX2CNR2
SCHEMBL8558176 0.72 MEN1 (0.46) KDM4ECCKBREPHX2
SCHEMBL8650316 0.71 CCKBR (0.47) CCKBR
SCHEMBL24352139 0.68 KDM4E (0.96) KDM4EEPHX2
SCHEMBL8866731 0.65 CCKBR (0.51) CCKBREPHX2
SCHEMBL7329951 0.64 L3MBTL1 (0.49) KDM4EKDM1AMAPT
SCHEMBL8557667 0.64 SIGMAR1 (0.49) KDM4EEPHX2CNR2

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