SCHEMBL6144891

SCHEMBL6144891

CC(C=O)c1ccc2c(c1)C(C)(C)CCC2(C)C

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
RXRA P19793 11/20 0.54
RXRB P28702 7/20 0.54
RARB P10826 12/20 0.46
RARG P13631 12/20 0.46
RARA P10276 9/20 0.46
CYP26A1 O43174 2/20 0.43
CYP3A4 P08684 2/20 0.43
CYP26B1 Q9NR63 1/20 0.43
RXRG P48443 4/20 0.41

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
SCHEMBL6144896 1.00 RXRA (0.54) RXRARXRBRARBRARGRARA
SCHEMBL29743366 0.83 RXRA (0.38) RXRARXRBRARBRARGRARA
SCHEMBL6554250 0.83 RXRA (0.38) RXRARXRBRARBRARGRARA
SCHEMBL7896493 0.83 RXRA (0.50) RXRARXRBRARBRARGRARA
SCHEMBL29638129 0.82 RXRA (0.38) RXRARXRBRARBRARGRARA
SCHEMBL3819800 0.81 RXRA (0.49) RXRARXRBRARBRARGRARA
SCHEMBL6146723 0.80 RXRA (0.48) RXRARXRBRARBRARGRARA
SCHEMBL6146729 0.80 RXRA (0.48) RXRARXRBRARBRARGRARA
SCHEMBL3175854 0.80 RXRA (0.57) RXRARXRBRARBRARGRARA
SCHEMBL8529271 0.79 RXRA (0.57) RXRARXRBRARBRARGRARA

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-1280757-B1 NEW GAMMA SELECTIVE RETINOIDS HOFFMANN LA ROCHE (CH) 2005-08-17 EP disclosed