SCHEMBL6564597

SCHEMBL6564597

CCc1cc(C(O)(CC)CC)ccc1-c1cc(COc2ccc(CO)c(CO)c2)cs1

nearest known ligand 0.61

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
VDR P11473 4/20 0.61
PPARG P37231 2/20 0.32
PPARD Q03181 2/20 0.32
PPARA Q07869 2/20 0.32
MAOB P27338 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
SCHEMBL6564145 0.91 VDR (0.55) VDRPPARGPPARDPPARAMAOB
SCHEMBL6566468 0.83 VDR (0.58) VDR
SCHEMBL6562954 0.83 VDR (0.57) VDRMAOB
SCHEMBL6564065 0.82 VDR (0.56) VDR
SCHEMBL2854911 0.81 VDR (0.88) VDRMAOB
SCHEMBL6564164 0.79 VDR (0.77) VDRPPARDMAOB
SCHEMBL4888601 0.78 VDR (0.92) VDRPPARGPPARDPPARAMAOB
SCHEMBL7612371 0.78 VDR (0.43) VDRMAOB
SCHEMBL7612366 0.78 VDR (0.39) VDR
SCHEMBL6889710 0.77 VDR (0.41) VDRPPARGPPARDPPARAMAOB

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1235777-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-06-16 EP claimed