SCHEMBL7559807

SCHEMBL7559807

CCOC(=O)/C=C(\C)C#C[Se]c1cc2c(cc1O)C(C)(C)CCC2(C)C

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RXRA P19793 16/20 0.36
RXRG P48443 12/20 0.36
RXRB P28702 11/20 0.36
RARB P10826 7/20 0.36
RARG P13631 6/20 0.36
RARA P10276 5/20 0.36
KDM4E B2RXH2 1/20 0.33
POLB P06746 1/20 0.33
MAPT P10636 1/20 0.33
PKM P14618 1/20 0.33
RAB9A P51151 1/20 0.33
GALK1 P51570 1/20 0.33
CCR6 P51684 1/20 0.33
BLM P54132 1/20 0.33
KMT2A Q03164 1/20 0.33
MCL1 Q07820 1/20 0.33
HKDC1 Q2TB90 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
CYP26A1 O43174 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
SCHEMBL6472789 1.00 RXRA (0.36) RXRARXRGRXRBRARBRARG
SCHEMBL7563931 0.91 RXRA (0.39) RXRARXRGRXRBRARBRARG
SCHEMBL6478019 0.91 RXRA (0.39) RXRARXRGRXRBRARBRARG
SCHEMBL6473196 0.86 RXRA (0.46) RXRARXRGRXRBRARBRARG
SCHEMBL7558629 0.86 RXRA (0.46) RXRARXRGRXRBRARBRARG
SCHEMBL7560513 0.85 RXRA (0.40) RXRARXRGRXRBRARBRARG
SCHEMBL7560510 0.85 RXRA (0.40) RXRARXRGRXRBRARBRARG
SCHEMBL7558455 0.83 RARB (0.38) RXRARXRGRXRBRARBRARG
SCHEMBL6472723 0.83 RARB (0.38) RXRARXRGRXRBRARBRARG
SCHEMBL6473487 0.83 RXRA (0.41) RXRARXRGRXRBRARBRARG

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
EP-0986537-B1 NOVEL HETEROETHYNYLENE COMPOUNDS AND PHARMACEUTICAL AND COSMETIC COMPOSITIONS CONTAINING SAME GALDERMA RES & DEV (FR) 2002-08-07 EP claimed