SCHEMBL5363613

SCHEMBL5363613

CCCOc1cc2c(cc1C1CCCc3oc(C=CC(=O)O)cc31)C(C)CC(C)C2(C)C

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 10/20 0.74
RARA P10276 1/20 0.33
RARB P10826 1/20 0.33
RARG P13631 1/20 0.33
RXRB P28702 1/20 0.33
RXRG P48443 1/20 0.33
KDM4E B2RXH2 1/20 0.32

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
SCHEMBL5363610 1.00 RXRA (0.74) RXRARARARARBRARGRXRB
SCHEMBL5368463 0.85 RXRA (1.00) RXRARARARARBRARGRXRB
SCHEMBL5368456 0.85 RXRA (1.00) RXRARARARARBRARGRXRB
SCHEMBL5361764 0.73 RXRA (1.00) RXRARARARARBRARGRXRB
SCHEMBL5361755 0.73 RXRA (1.00) RXRARARARARBRARGRXRB
SCHEMBL5371773 0.72 RXRA (0.77) RXRARARARARBRARGRXRB
SCHEMBL5356964 0.68 RXRA (1.00) RXRARARARARBRARGRXRB
SCHEMBL5356973 0.68 RXRA (1.00) RXRARARARARBRARGRXRB
SCHEMBL13752411 0.67 RXRA (0.72) RXRARARARARBRARGRXRB
SCHEMBL5356750 0.66 RXRA (1.00) RXRARARARARBRARG

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-7173134-B2 Selective RXR ligands SMITHKLINE BEECHAM CORPORATION (US) 2007-02-06 US claimed