SCHEMBL6155487

SCHEMBL6155487

CC/C(=C/CCC(O)(CC)CC)c1cccc(COc2ccc(CO)c(C)c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.52
MRGPRX4 Q96LA9 9/20 0.41
SMN1; SMN2 Q16637 3/20 0.38
TP53 P04637 2/20 0.38
PKM P14618 2/20 0.38
NFKB1 P19838 2/20 0.38
NFKB2 Q00653 2/20 0.38
RELA Q04206 2/20 0.38
FFAR1 O14842 1/20 0.38
MAOB P27338 3/20 0.36
RAB9A P51151 2/20 0.35
PRKD3 O94806 1/20 0.35
S1PR1 P21453 1/20 0.35
CDK7 P50613 1/20 0.35
JAK3 P52333 1/20 0.35
TNK2 Q07912 1/20 0.35
S1PR5 Q9H228 1/20 0.35
F2 P00734 1/20 0.35
RXFP1 Q9HBX9 1/20 0.35
NPC1 O15118 1/20 0.35

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
SCHEMBL6155490 1.00 VDR (0.52) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL6155480 1.00 VDR (0.52) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL6155220 0.93 VDR (0.51) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL6155215 0.93 VDR (0.51) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL6155222 0.93 VDR (0.51) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL2783367 0.93 VDR (0.57) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL2783364 0.93 VDR (0.57) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL2783371 0.93 VDR (0.57) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL6155547 0.88 VDR (0.50) VDRMRGPRX4SMN1; SMN2TP53PKM
SCHEMBL6155539 0.88 VDR (0.50) VDRMRGPRX4SMN1; SMN2TP53PKM

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 6 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 claimed
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 claimed
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