SCHEMBL9857466

SCHEMBL9857466

CCOC(=O)CC(CC(CCOS(=O)(=O)C(F)(F)F)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C)O[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HSD11B1 P28845 1/20 0.33
HSD17B10 Q99714 3/20 0.33
KMT2A Q03164 3/20 0.33
MAPT P10636 3/20 0.33
TP53 P04637 2/20 0.33
HPGD P15428 2/20 0.33
MAPK1 P28482 2/20 0.33
NPSR1 Q6W5P4 2/20 0.33
TLR9 Q9NR96 2/20 0.33
RAB9A P51151 1/20 0.33
BCL2A1 Q16548 1/20 0.33
TSHR P16473 2/20 0.33
ALDH1A1 P00352 2/20 0.33
SMN1; SMN2 Q16637 2/20 0.32
S1PR4 O95977 1/20 0.32
LMNA P02545 1/20 0.32
S1PR1 P21453 1/20 0.32
STAT3 P40763 1/20 0.32
STAT1 P42224 1/20 0.32
F2 P00734 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
SCHEMBL9857481 0.83 F2 (0.38) KMT2AMAPTHPGDRAB9ATSHR
SCHEMBL10779090 0.81 TSHR (0.39) HSD11B1KMT2ANPSR1TSHRALDH1A1
SCHEMBL9347640 0.81 TSHR (0.44) HSD11B1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL12787299 0.78 TSHR (0.38) HSD11B1KMT2ATSHRALDH1A1F2
SCHEMBL23529640 0.78 TSHR (0.41) HSD11B1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL2915807 0.78 TSHR (0.41) HSD11B1KMT2ATSHRALDH1A1F2
SCHEMBL2915808 0.78 TSHR (0.41) HSD11B1KMT2ATSHRALDH1A1F2
SCHEMBL29772371 0.78 TSHR (0.41) HSD11B1KMT2ATSHRALDH1A1SMN1; SMN2
SCHEMBL9857471 0.78 PPID (0.41) KMT2AMAPTALDH1A1SMN1; SMN2F2
SCHEMBL9730290 0.77 TSHR (0.38) HSD11B1KMT2AMAPTTSHRALDH1A1

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-0436851-A1 Compounds active as inhibitors of the enzyme HMG-CoA reductase and pharmaceutical compositions containing them ZAMBON GROUP S.p.A. (IT) 1991-07-17 EP disclosed