SCHEMBL6566217

SCHEMBL6566217

CCC(=O)c1ccc(COc2ccc(CO[Si](C)(C)C(C)(C)C)c(CO[Si](C)(C)C(C)(C)C)c2)s1

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
POLB P06746 3/20 0.36
TDP1 Q9NUW8 2/20 0.36
HDAC4 P56524 1/20 0.35
HDAC6 Q9UBN7 1/20 0.35
MRGPRX4 Q96LA9 2/20 0.33
MAPT P10636 5/20 0.32
HPGD P15428 2/20 0.32
MEN1 O00255 2/20 0.32
KMT2A Q03164 2/20 0.32
LMNA P02545 2/20 0.32
BACE1 P56817 1/20 0.32
RAB9A P51151 4/20 0.31
NPC1 O15118 3/20 0.31
ALDH1A1 P00352 3/20 0.31
SMN1; SMN2 Q16637 2/20 0.31
HTT P42858 2/20 0.31
CCNC P24863 1/20 0.31
CDK8 P49336 1/20 0.31
FFAR1 O14842 1/20 0.31
ATM Q13315 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
SCHEMBL6882723 0.87 HDAC4 (0.32) HDAC4HDAC6MRGPRX4BACE1FFAR1
SCHEMBL6882719 0.87 HDAC4 (0.32) HDAC4HDAC6MRGPRX4BACE1FFAR1
SCHEMBL6562926 0.87 HDAC4 (0.32) HDAC4HDAC6MRGPRX4BACE1FFAR1
SCHEMBL6888029 0.85 HDAC4 (0.31) HDAC4HDAC6BACE1
SCHEMBL6888025 0.85 HDAC4 (0.31) HDAC4HDAC6BACE1
SCHEMBL6564641 0.85 HDAC4 (0.31) HDAC4HDAC6BACE1
SCHEMBL6887623 0.85
SCHEMBL6564817 0.85
SCHEMBL6887629 0.85
SCHEMBL6566203 0.84 FFAR1 (0.35) POLBTDP1HDAC4HDAC6MRGPRX4

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-1235824-B1 VITAMIN D ANALOGUES GALDERMA RES & DEV (FR) 2004-05-19 EP disclosed
US-6706725-B1 BIAROMATIC COMPOUNDS WHICH ARE VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2004-03-16 US disclosed
EP-1235824-A1 VITAMIN D ANALOGUES Galderma Research & Development, S.N.C. (FR) 2002-09-04 EP disclosed
WO-2001038320-A1 VITAMIN D ANALOGUES GALDERMA RESEARCH & DEVELOPMENT, S.N.C. (FR) 2001-05-31 WO disclosed