SCHEMBL6155986

SCHEMBL6155986

CC(=O)c1cccc(N(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 0.39

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 2/20 0.39
KDM4E B2RXH2 2/20 0.33
ALDH1A1 P00352 2/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
MAOB P27338 6/20 0.32
KMT2A Q03164 2/20 0.32
RXRA P19793 1/20 0.32
RXRB P28702 1/20 0.32
RXRG P48443 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
MAOA P21397 2/20 0.32
FYN P06241 1/20 0.31
MEN1 O00255 1/20 0.30
FFAR1 O14842 1/20 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
SCHEMBL6884341 0.86 PPARA (0.35) PPARAFFAR1
SCHEMBL6886723 0.83 MAOB (0.37) MAOBMAOA
SCHEMBL6884382 0.75 MAOB (0.50) MAOBMAOA
SCHEMBL6885341 0.74 ACACB (0.43) HPGD
SCHEMBL3279984 0.72 CYP4F2 (0.34) PPARAALDH1A1MAPTHPGD
SCHEMBL6158543 0.70 PPARA (0.47) PPARAKDM4EALDH1A1MAPTHPGD
SCHEMBL6155897 0.70 PPARA (0.45) PPARAKDM4EALDH1A1MAPTHPGD
SCHEMBL6155995 0.69 PPARA (0.41) PPARAKDM4EALDH1A1MAPTHPGD
SCHEMBL1366154 0.69 KIF11 (0.35) ALDH1A1MAPTHPGDMAOBL3MBTL1
SCHEMBL6155990 0.69 PPARA (0.42) PPARAKDM4EALDH1A1MAPTHPGD

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