SCHEMBL9730290

SCHEMBL9730290

CCOC(=O)CC(CC(C=O)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 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.38
ALDH1A1 P00352 2/20 0.38
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
PIN1 Q13526 1/20 0.34
F2 P00734 1/20 0.34
NPC1 O15118 1/20 0.33
CYP3A4 P08684 1/20 0.33
CYP2D6 P10635 1/20 0.33
CYP2C19 P33261 1/20 0.33
HSD11B1 P28845 1/20 0.33
PPID Q08752 1/20 0.33
MDM4 O15151 1/20 0.33
LMNA P02545 1/20 0.33
MAPT P10636 1/20 0.33
MDM2 Q00987 1/20 0.33
POLB P06746 1/20 0.33
PRNP P04156 1/20 0.33

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
SCHEMBL30895707 0.89 MEN1 (0.36) ALDH1A1MEN1KMT2APIN1NPC1
SCHEMBL9300094 0.88 KCNA5 (0.37) TSHRALDH1A1KMT2AMAPT
SCHEMBL9856975 0.88 ALDH1A1 (0.34) TSHRALDH1A1MEN1KMT2APIN1
SCHEMBL9856810 0.88 TSHR (0.34) TSHRALDH1A1MEN1KMT2APIN1
SCHEMBL9347640 0.88 TSHR (0.44) TSHRALDH1A1MEN1KMT2APIN1
SCHEMBL10694453 0.87 PTPRC (0.34) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL10434071 0.87 PTPRC (0.34) ALDH1A1MEN1KMT2AMAPTPOLB
SCHEMBL10433967 0.87 MAPT (0.35) CYP3A4MAPT
SCHEMBL9828488 0.87 MAPT (0.35) CYP3A4MAPT
SCHEMBL12787298 0.86 TSHR (0.39) TSHRALDH1A1MEN1KMT2APIN1

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
US-5081136-A 1,2,3-TRIAZOLE COMPOUNDS ACTIVE AS INHIBITORS OF THE ENZYME HMG-COA REDUCTASE AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZAMBON GROUP S.P.A. (IT) 1992-01-14 US disclosed
EP-0433842-A2 1,2,3-Triazole derivatives active as inhibitors of the enzyme HMG-COA reductase and pharmaceutical compositions containing them ZAMBON GROUP S.p.A. (IT) 1991-06-26 EP disclosed
US-4939159-A Azaindole derivatives useful as cholesterol biosynthesis inhibitors SANDOZ PHARM. CORP. (US) 1990-07-03 US disclosed
US-4613610-A TREATING ATHEROSCLEROSIS AND HYPERLIPEMIA SANDOZ PHARMACEUTICALS CORP. (US) 1986-09-23 US disclosed