SCHEMBL6885569

SCHEMBL6885569

CC(C)(C)[Si](C)(C)OCc1ccc(C#Cc2cccc(CCCCCC(=O)O)c2)cc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.46

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 16/20 0.46
FFAR4 Q5NUL3 6/20 0.42
MAPT P10636 1/20 0.40
RXFP1 Q9HBX9 1/20 0.40
RXRA P19793 1/20 0.37
NR1H2 P55055 1/20 0.37
NR1H3 Q13133 1/20 0.37
TBXAS1 P24557 1/20 0.37

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
SCHEMBL6878730 0.90 FFAR1 (0.40) FFAR1FFAR4
SCHEMBL6884926 0.86 FFAR1 (0.34) FFAR1FFAR4
SCHEMBL6156487 0.80 CYSLTR2 (0.50) FFAR1FFAR4RXRANR1H2NR1H3
SCHEMBL7777946 0.79 FFAR1 (0.35) FFAR1FFAR4
SCHEMBL6155420 0.77 ACACB (0.43)
SCHEMBL6155454 0.73 MAPT (0.40) MAPTRXFP1TBXAS1
SCHEMBL6155458 0.73 MAPT (0.40) MAPTRXFP1TBXAS1
SCHEMBL7775456 0.71 FFAR1 (0.44) FFAR1FFAR4MAPTRXFP1
SCHEMBL6881362 0.71 BACE1 (0.35) FFAR1FFAR4RXRA
SCHEMBL6881366 0.71 BACE1 (0.35) FFAR1FFAR4RXRA

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 3 patents. 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
EP-1124779-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2001-08-22 EP disclosed
WO-2000026167-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2000-05-11 WO disclosed