SCHEMBL6881369

SCHEMBL6881369

CC(=CC=CC(=O)O)c1cccc(C#Cc2ccc(C(O[SiH](C)C)C(C)(C)C)c(C(O[SiH](C)C)C(C)(C)C)c2)c1

nearest known ligand 0.32

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
RARA P10276 1/20 0.32
RARB P10826 1/20 0.32
RARG P13631 1/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
ACACB O00763 3/20 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
SCHEMBL6885341 0.84 ACACB (0.43) ACACB
SCHEMBL6884303 0.83 SLC7A5 (0.32) RARARARBRARGRXRARXRB
SCHEMBL3279428 0.72 VDR (0.40)
SCHEMBL6155477 0.71 RARA (0.33) RARARARBRARGRXRARXRB
SCHEMBL6878947 0.70 MRGPRX4 (0.40)
SCHEMBL6878959 0.70 MRGPRX4 (0.40)
SCHEMBL6885244 0.70
SCHEMBL6885229 0.70
SCHEMBL6881366 0.70 BACE1 (0.35) RARARARBRARGRXRARXRB
SCHEMBL6881362 0.70 BACE1 (0.35) RARARARBRARGRXRARXRB

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
US-6689922-B1 BIAROMATIC COMPOUNDS WHICH ARE ANALOGUES OF VITAMIN D HAVE A MARKED ACTIVITY IN THE FIELDS OF CELL DIFFERENTIATION AND PROLIFERATION GALDERMA RESEARCH & DEVELOPMENT S.N.C. (FR) 2004-02-10 US disclosed