SCHEMBL6155175

SCHEMBL6155175

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

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSP90AA1 P07900 1/20 0.43
HSP90AB1 P08238 1/20 0.43
CA12 O43570 4/20 0.37
CA1 P00915 4/20 0.37
CA9 Q16790 4/20 0.37
CYP26B1 Q9NR63 3/20 0.36
ALDH1A1 P00352 2/20 0.35
KDM4E B2RXH2 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
EDNRB P24530 1/20 0.33
EDNRA P25101 1/20 0.33
MAPT P10636 1/20 0.33
NPSR1 Q6W5P4 1/20 0.32
CYP26A1 O43174 1/20 0.32
PREP P48147 1/20 0.32
PPARG P37231 1/20 0.32
PPARA Q07869 1/20 0.32
RHOA P61586 1/20 0.32
PKM P14618 1/20 0.32
LPAR1 Q92633 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
SCHEMBL6155168 1.00 HSP90AA1 (0.43) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155230 0.91 HSP90AA1 (0.41) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155225 0.91 HSP90AA1 (0.41) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155576 0.80 CA12 (0.42) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6155570 0.79 CYP4F2 (0.44) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL17513851 0.78 HSP90AA1 (0.61) HSP90AA1HSP90AB1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL17513850 0.78 HSP90AA1 (0.61) HSP90AA1HSP90AB1ALDH1A1KDM4ESMN1; SMN2
SCHEMBL28433092 0.76 HSP90AA1 (0.42) HSP90AA1HSP90AB1CA12CA1CA9
SCHEMBL6154937 0.74 KIF11 (0.40) HSP90AA1CA12CA1CA9CYP26B1
SCHEMBL6154943 0.74 KIF11 (0.40) HSP90AA1CA12CA1CA9CYP26B1

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