SCHEMBL15947712

SCHEMBL15947712

COC(=O)[C@@H]1N=C(c2ccccc2OCc2ccccc2)O[C@@H]1C

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
RXRA P19793 2/20 0.47
RXRB P28702 1/20 0.47
RXRG P48443 1/20 0.47
PTGER1 P34995 4/20 0.46
MCL1 Q07820 1/20 0.43
BRD4 O60885 4/20 0.43
PTGER4 P35408 3/20 0.42
PTGER3 P43115 3/20 0.42
PTGER2 P43116 3/20 0.42
ERN1 O75460 1/20 0.42
IDO1 P14902 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
SCHEMBL15942231 1.00 RXRA (0.47) RXRARXRBRXRGPTGER1MCL1
SCHEMBL15942232 1.00 RXRA (0.47) RXRARXRBRXRGPTGER1MCL1
SCHEMBL21022931 0.92 PTGER1 (0.42) RXRARXRBRXRGPTGER1MCL1
SCHEMBL17402231 0.91 RXRA (0.47) RXRARXRBRXRGPTGER1MCL1
SCHEMBL15941028 0.91 RXRA (0.49) RXRARXRBRXRGPTGER1MCL1
SCHEMBL15942310 0.91 RXRA (0.49) RXRARXRBRXRGPTGER1MCL1
SCHEMBL15941208 0.91 RXRA (0.49) RXRARXRBRXRGPTGER1MCL1
SCHEMBL15942243 0.91 RXRA (0.49) RXRARXRBRXRGPTGER1MCL1
SCHEMBL17389334 0.91 RXRA (0.49) RXRARXRBRXRGPTGER1MCL1
SCHEMBL17389349 0.87 RXRA (0.44) RXRARXRBRXRGPTGER1MCL1

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
WO-2014122664-A1 LANTHANIDE CLUSTERS AND METHODS OF USE THEREOF YEDA RESEARCH AND DEVELOPMENT CO. LTD. (IL) 2014-08-14 WO disclosed