SCHEMBL6566493

SCHEMBL6566493

CCC(O)(CC)c1ccc(-c2cc(COc3ccc(CO)c(CO)c3)sc2C)c(C)c1

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
VDR P11473 3/20 0.51
LMNA P02545 1/20 0.31
POLB P06746 1/20 0.31
RAB9A P51151 1/20 0.31
ATM Q13315 1/20 0.31
L3MBTL1 Q9Y468 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
SCHEMBL6563004 0.88 VDR (0.51) VDR
SCHEMBL6566427 0.85 VDR (0.51) VDRLMNAPOLBRAB9AATM
SCHEMBL6566504 0.82 VDR (0.50) VDR
SCHEMBL6565142 0.81 VDR (0.61) VDR
SCHEMBL6564192 0.79 VDR (0.68) VDRLMNA
SCHEMBL6562954 0.78 VDR (0.57) VDRLMNAPOLBRAB9AATM
SCHEMBL6564145 0.78 VDR (0.55) VDR
SCHEMBL6563016 0.78 VDR (0.80) VDR
SCHEMBL6563025 0.77 VDR (0.58) VDR
SCHEMBL6562993 0.76 VDR (0.65) 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