SCHEMBL7685329

SCHEMBL7685329

CCOC(=O)/C=C(\C)C=CC=C(C)c1ccc(OC(OC)OCC)c(C(C)(C)C)c1

nearest known ligand 0.40

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
RXRA P19793 18/20 0.40
RARG P13631 15/20 0.40
PPARG P37231 13/20 0.40
RARA P10276 6/20 0.37
RARB P10826 6/20 0.37
RXRB P28702 4/20 0.37
RXRG P48443 4/20 0.37
KDM4E B2RXH2 1/20 0.32
MEN1 O00255 1/20 0.32
MAPT P10636 1/20 0.32
KMT2A Q03164 1/20 0.32
ATM Q13315 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
SCHEMBL8567145 0.91 RXRA (0.50) RXRARARGPPARGRARARARB
SCHEMBL7685302 0.91 RXRA (0.50) RXRARARGPPARGRARARARB
SCHEMBL7686291 0.86 RARG (0.49) RXRARARGPPARGRARARARB
SCHEMBL7686290 0.86 RARG (0.49) RXRARARGPPARGRARARARB
SCHEMBL7686292 0.86 RARG (0.49) RXRARARGPPARGRARARARB
SCHEMBL7685332 0.85 RXRA (0.44) RXRARARGPPARGRARARARB
SCHEMBL7685327 0.85 RXRA (0.44) RXRARARGPPARGRARARARB
SCHEMBL7685593 0.81 RARA (0.41) RARGRARARARB
SCHEMBL7684901 0.81 RARA (0.43) RXRARARGPPARGRARARARB
SCHEMBL7689448 0.80 RARG (0.46) RXRARARGPPARGRARARARB

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-RE37947-E1 Aromatic polyenic compounds and pharmaceutical/cosmetic compositions comprised thereof CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 2002-12-31 US disclosed
US-5705167-A TREATMENT OF DERMATOLOGICAL, RHEUMATIC, RESPIRATORY, CARDIOVASCULAR, BONE AND OPHTHALMOLOGICAL DISORDERS CENTRE INTERNATIONAL DE RECHERCHES DERMATOLOGIQUES GALDERMA (FR) 1998-01-06 US disclosed