SCHEMBL6565142

SCHEMBL6565142

CCC(O)(CC)c1ccc(-c2cc(CCc3ccc(CO)c(CO)c3)sc2C)c(C)c1

nearest known ligand 0.61

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
VDR P11473 4/20 0.61
PTGDR2 Q9Y5Y4 1/20 0.30

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
SCHEMBL6564932 0.87 VDR (0.61) VDR
SCHEMBL6563023 0.85 VDR (0.61) VDR
SCHEMBL6562980 0.84 VDR (0.83) VDRPTGDR2
SCHEMBL6564130 0.82 VDR (0.60) VDR
SCHEMBL6566493 0.81 VDR (0.51) VDR
SCHEMBL7649265 0.80 VDR (0.38) VDR
SCHEMBL6564956 0.79 VDR (0.62) VDR
SCHEMBL6565015 0.77 VDR (0.57) VDR
SCHEMBL7649262 0.77 VDR (0.38) VDR
SCHEMBL27568027 0.77 VDR (0.71) VDR

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 2 patents. 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
CN-1423627-A Vitamin D analogues GALDERMA RES & DEV (FR) 2003-06-11 CN claimed