SCHEMBL7208544

SCHEMBL7208544

CCCCOc1cc2c(cc1/C=C/C=C/C(C)=C/C(=O)O)C1(C)CCCC2(C)C1O

nearest known ligand 0.51

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 20/20 0.51
RXRG P48443 16/20 0.51
RXRB P28702 14/20 0.51
RARB P10826 7/20 0.51
RARG P13631 6/20 0.51
RARA P10276 6/20 0.51
PPARG P37231 4/20 0.37

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
SCHEMBL8595293 0.90 RXRA (0.41) RXRARXRGRXRBRARBRARG
SCHEMBL7207118 0.86 RXRA (0.45) RXRARXRGRXRBRARBRARG
SCHEMBL7061862 0.85 RXRA (0.63) RXRARXRGRXRBRARBRARG
SCHEMBL7212158 0.85 RXRA (0.63) RXRARXRGRXRBRARBRARG
SCHEMBL7061866 0.85 RXRA (0.63) RXRARXRGRXRBRARBRARG
SCHEMBL7208727 0.83 RXRA (0.71) RXRARXRGRXRBRARBRARG
SCHEMBL7208488 0.83 RXRA (0.71) RXRARXRGRXRBRARBRARG
SCHEMBL7208494 0.83 RXRA (0.71) RXRARXRGRXRBRARBRARG
SCHEMBL8597944 0.78 RXRA (0.37) RXRARXRGRXRBRARBRARG
SCHEMBL7207780 0.77 RARA (0.48) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0641759-B1 Use of aromatic carboxylic derivatives for the preparation of drugs HOFFMANN LA ROCHE (CH) 1998-12-09 EP claimed
EP-0641759-A1 Aromatic carboxylic acid derivatives, their preparation and drugs containing these derivatives F. HOFFMANN-LA ROCHE AG (CH) 1995-03-08 EP claimed
US-6610877-B1 Treating photo and/or age damaged skin HOFFMAN-LA ROCHE INC. 2003-08-26 US disclosed
US-5700836-A TOPICALLY ADMINISTERING TO TREAT PHOTODAMAGED SKIN HOFFMANN-LA ROCHE INC. (US) 1997-12-23 US disclosed