SCHEMBL6155969

SCHEMBL6155969

CC(C)(C)[Si](C)(C)OCc1ccc(I)cc1CO[Si](C)(C)C(C)(C)C

nearest known ligand 0.38

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
IDO1 P14902 2/20 0.38
BACE1 P56817 1/20 0.35
PREP P48147 1/20 0.31
DUT P33316 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
SCHEMBL9469042 0.87 BACE1 (0.34) IDO1BACE1PREP
SCHEMBL31537474 0.85 IDO1 (0.36) IDO1BACE1
SCHEMBL6119427 0.85 BACE1 (0.33) IDO1BACE1PREP
SCHEMBL12002597 0.85 IDO1 (0.57) IDO1BACE1
SCHEMBL1367295 0.85 IDO1 (0.38) IDO1BACE1
SCHEMBL4513196 0.79 GAA (0.37) BACE1PREP
SCHEMBL3366390 0.79 IDO1 (0.38) IDO1BACE1
SCHEMBL6885043 0.79 BACE1 (0.33) BACE1
SCHEMBL17798345 0.79 BACE1 (0.36) IDO1BACE1
SCHEMBL6438766 0.77 IDO1 (0.53) IDO1BACE1DUT

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