SCHEMBL6156078

SCHEMBL6156078

CCC(=CCCC(CC)(CC)O[Si](CC)(CC)CC)c1cccc(CO)c1

nearest known ligand 0.36

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PRSS1 P07477 1/20 0.36
PRSS2 P07478 1/20 0.36
PRSS3 P35030 1/20 0.36
VDR P11473 2/20 0.34
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
F10 P00742 1/20 0.31

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
SCHEMBL6156076 1.00 PRSS1 (0.36) PRSS1PRSS2PRSS3VDRPTGS1
SCHEMBL6156073 1.00 PRSS1 (0.36) PRSS1PRSS2PRSS3VDRPTGS1
SCHEMBL6156808 0.87 PRSS1 (0.37) PRSS1PRSS2PRSS3PTGS1PTGS2
SCHEMBL6156807 0.87 PRSS1 (0.37) PRSS1PRSS2PRSS3PTGS1PTGS2
SCHEMBL6156405 0.86 PTGS1 (0.34) PTGS1PTGS2
SCHEMBL6156409 0.86 PTGS1 (0.34) PTGS1PTGS2
SCHEMBL6566186 0.84
SCHEMBL6566192 0.84
SCHEMBL7050636 0.83 PTGS1 (0.32) PTGS1PTGS2
SCHEMBL7050628 0.83 PTGS1 (0.32) PTGS1PTGS2

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