SCHEMBL6155420

SCHEMBL6155420

CC(=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 0.45

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ACACB O00763 7/20 0.43
BACE1 P56817 1/20 0.36
MAOB P27338 2/20 0.34
HPGD P15428 2/20 0.34
LMNA P02545 1/20 0.34
RAB9A P51151 1/20 0.34

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
SCHEMBL6881362 0.84 BACE1 (0.35) ACACBBACE1
SCHEMBL6881366 0.84 BACE1 (0.35) ACACBBACE1
SCHEMBL6155470 0.84 BACE1 (0.35) ACACBBACE1
SCHEMBL6156231 0.81 MAOB (0.41) BACE1MAOB
SCHEMBL7777946 0.79 FFAR1 (0.35) BACE1
SCHEMBL22432227 0.77 PKM (0.40) BACE1HPGD
SCHEMBL6155252 0.77 MAOB (0.52) MAOBRAB9A
SCHEMBL6885569 0.77 FFAR1 (0.46)
SCHEMBL6155990 0.76 PPARA (0.42) BACE1MAOBHPGDLMNARAB9A
SCHEMBL6878730 0.75 FFAR1 (0.40)

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