SCHEMBL6563146

SCHEMBL6563146

CC(C)(C)[Si](C)(C)OCc1ccc(OCc2cc(C=O)cs2)cc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.33

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
BACE1 P56817 1/20 0.33
NPC1 O15118 2/20 0.33
RAB9A P51151 2/20 0.33
TDP1 Q9NUW8 1/20 0.33
MAOA P21397 3/20 0.31
MAOB P27338 3/20 0.31
MEN1 O00255 1/20 0.30
KMT2A Q03164 1/20 0.30
KDM4E B2RXH2 1/20 0.30
ALDH1A1 P00352 1/20 0.30
L3MBTL1 Q9Y468 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
SCHEMBL17410684 0.85 BACE1 (0.33) BACE1
SCHEMBL7606423 0.85
SCHEMBL6563887 0.83 MGMT (0.35) RAB9AL3MBTL1
SCHEMBL7649567 0.80
SCHEMBL6564967 0.79 VDR (0.31)
SCHEMBL6886432 0.79 VDR (0.31)
SCHEMBL6886436 0.79 VDR (0.31)
SCHEMBL6563010 0.79 MAPT (0.33) BACE1NPC1RAB9ATDP1MEN1
SCHEMBL6563085 0.77 CA2 (0.30)
SCHEMBL7616233 0.77 LTA4H (0.34)

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-1235824-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-05-19 EP disclosed
US-6706725-B1 BIAROMATIC COMPOUNDS WHICH ARE VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-03-16 US disclosed
EP-1235824-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038320-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed