SCHEMBL6155239

SCHEMBL6155239

CC(C)(CCCO)c1cccc(O[Si](C)(C)C(C)(C)C)c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CNR1 P21554 10/20 0.41
CNR2 P34972 10/20 0.41
HSP90AA1 P07900 1/20 0.38
HSP90AB1 P08238 1/20 0.38
CA12 O43570 4/20 0.36
CA1 P00915 4/20 0.36
CA9 Q16790 4/20 0.36
PREP P48147 1/20 0.34
LMNA P02545 1/20 0.33
POLB P06746 1/20 0.33
HTT P42858 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
ALDH1A1 P00352 1/20 0.32
TP53 P04637 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP3A4 P08684 1/20 0.32
ALOX15 P16050 1/20 0.32
TSHR P16473 1/20 0.32
NFKB1 P19838 1/20 0.32
MAPK1 P28482 1/20 0.32

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
SCHEMBL6156340 0.85 CA12 (0.39) CNR1CNR2HSP90AA1HSP90AB1CA12
SCHEMBL7706827 0.75 CA1 (0.50) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL2635979 0.74 CYP4F2 (0.50) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL29851528 0.73 KDR (0.41) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL559965 0.73 KDR (0.41) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155570 0.72 CYP4F2 (0.44) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6154830 0.72 HSP90AA1 (0.35) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL4004898 0.72 CYP3A4 (0.47) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155576 0.71 CA12 (0.42) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL30628285 0.71 CA12 (0.44) HSP90AA1HSP90AB1CA12CA1CA9

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