SCHEMBL8749983

SCHEMBL8749983

C=C(OCC)c1cc(C(C)(C)C)cc2c1CCC2(C)C

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
RXRA P19793 7/20 0.55
RXRG P48443 6/20 0.41
RXRB P28702 5/20 0.39

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
SCHEMBL7083828 0.82 RXRA (0.53) RXRARXRGRXRB
SCHEMBL7085844 0.80 RXRA (0.60) RXRARXRGRXRB
SCHEMBL8417710 0.78 RXRA (0.56) RXRARXRGRXRB
SCHEMBL7085816 0.77 RXRA (0.58) RXRARXRGRXRB
SCHEMBL29374183 0.76 RXRA (0.63) RXRARXRGRXRB
SCHEMBL112943 0.76 RXRA (0.63) RXRARXRGRXRB
SCHEMBL3633427 0.75 RXRA (0.65) RXRARXRGRXRB
SCHEMBL9770686 0.74 RXRA (0.49) RXRARXRGRXRB
SCHEMBL13807401 0.74 RXRA (0.57) RXRARXRGRXRB
SCHEMBL7081379 0.73 RXRA (0.59) RXRARXRGRXRB

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0595197-B1 Enol ethers and odorant compositions containing them GIVAUDAN ROURE INT (CH) 1997-04-02 EP claimed
US-5332725-A Perfumes of alkyl substituted oxotetralin or oxoindanes GIVAUDAN-ROURE CORPORATION (US) 1994-07-26 US claimed
EP-0595197-A1 Enol ethers and odorant compositions containing them GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1994-05-04 EP claimed
EP-0595197-B1 Enol ethers and odorant compositions containing them GIVAUDAN ROURE INT (CH) 1997-04-02 EP disclosed
US-5332725-A Perfumes of alkyl substituted oxotetralin or oxoindanes GIVAUDAN-ROURE CORPORATION (US) 1994-07-26 US disclosed
EP-0595197-A1 Enol ethers and odorant compositions containing them GIVAUDAN-ROURE (INTERNATIONAL) S.A. (CH) 1994-05-04 EP disclosed