SCHEMBL6155470

SCHEMBL6155470

C/C(=C\C=C\C(=O)O)c1cccc(C#Cc2ccc(CO[Si](C)(C)C(C)(C)C)c(CO[Si](C)(C)C(C)(C)C)c2)c1

nearest known ligand 0.35

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.35
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 7/20 0.31
FFAR1 O14842 4/20 0.30
EGLN1 Q9GZT9 1/20 0.30
FFAR4 Q5NUL3 2/20 0.30

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
SCHEMBL6881366 1.00 BACE1 (0.35) BACE1RARARARBRARGRXRA
SCHEMBL6881362 1.00 BACE1 (0.35) BACE1RARARARBRARGRXRA
SCHEMBL6884293 0.84 BACE1 (0.35) BACE1RARARARBRARGRXRA
SCHEMBL6155830 0.84 BACE1 (0.35) BACE1RARARARBRARGRXRA
SCHEMBL6884295 0.84 BACE1 (0.35) BACE1RARARARBRARGRXRA
SCHEMBL6155420 0.84 ACACB (0.43) BACE1ACACB
SCHEMBL6155642 0.81 MRGPRX4 (0.40)
SCHEMBL6155645 0.81 MRGPRX4 (0.40)
SCHEMBL7777946 0.73 FFAR1 (0.35) BACE1FFAR1FFAR4
SCHEMBL6156525 0.73 HSP90AA1 (0.41) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1124779-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2005-02-02 EP disclosed
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