SCHEMBL8334596

SCHEMBL8334596

CCOC(=O)/C=C(C)/C=C/[C@H]1C[C@@]1(C)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.74

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RXRA P19793 20/20 0.74
RXRG P48443 13/20 0.74
RXRB P28702 11/20 0.74
RARB P10826 7/20 0.74
RARG P13631 7/20 0.74
RARA P10276 3/20 0.74
PPARG P37231 1/20 0.74

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
SCHEMBL8340075 1.00 RXRA (0.74) RXRARXRGRXRBRARBRARG
SCHEMBL21017664 1.00 RXRA (0.74) RXRARXRGRXRBRARBRARG
SCHEMBL8469690 1.00 RXRA (0.74) RXRARXRGRXRBRARBRARG
SCHEMBL8328231 1.00 RXRA (0.74) RXRARXRGRXRBRARBRARG
SCHEMBL15131759 0.89 RXRA (0.78) RXRARXRGRXRBRARBRARG
SCHEMBL6225268 0.85 RXRA (0.54) RXRARXRGRXRBRARBRARG
SCHEMBL6225273 0.85 RXRA (0.54) RXRARXRGRXRBRARBRARG
SCHEMBL6222353 0.85 RXRA (0.54) RXRARXRGRXRBRARBRARG
SCHEMBL6222487 0.85 RXRA (0.54) RXRARXRGRXRBRARBRARG
Irx-4204 SCHEMBL24767436 0.85 RXRA (1.00) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5917082-A 2,4-pentadienoic acid derivatives having retinoid-like biological activity ALLERGAN SALES, INC. (US) 1999-06-29 US disclosed
WO-1999008992-A1 2,4-PENTADIENOIC ACID DERIVATIVES HAVING RETINOID-LIKE BIOLOGICAL ACTIVITY ALLERGAN SALES, INC. (US) 1999-02-25 WO disclosed