SCHEMBL9302117

SCHEMBL9302117

C[Si](Cl)(c1ccccc1)c1cccc2ccccc12

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2A6 P11509 5/20 0.39
ALDH1A1 P00352 5/20 0.39
CYP1A2 P05177 5/20 0.39
TSHR P16473 5/20 0.36
HSD17B10 Q99714 4/20 0.36
TDP1 Q9NUW8 2/20 0.36
HPGD P15428 3/20 0.34
CYP3A4 P08684 3/20 0.34
KEAP1 Q14145 1/20 0.34
NR4A1 P22736 1/20 0.34
NR4A2 P43354 1/20 0.34
NR4A3 Q92570 1/20 0.34
TP53 P04637 2/20 0.34
MAPK1 P28482 2/20 0.34
ATM Q13315 2/20 0.34
MAPT P10636 2/20 0.34
SMN1; SMN2 Q16637 2/20 0.34
KDM4E B2RXH2 1/20 0.34
NFKB1 P19838 1/20 0.34
NFKB2 Q00653 1/20 0.34

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
SCHEMBL17966499 0.88 CYP2A6 (0.44) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL12124319 0.80 ESR1 (0.42) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL13964953 0.80 ALDH1A1 (0.41) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL8207775 0.80 CYP1A2 (0.41) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL31643929 0.80 CYP1A2 (0.41) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL8216176 0.79 CYP2A6 (0.44) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL10319492 0.79 CYP2A6 (0.44) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL5063120 0.78 CYP1A2 (0.45) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
SCHEMBL11524427 0.77 ALDH1A1 (0.39) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10
Potassium Ion SCHEMBL10641926 0.76 ALDH1A1 (0.38) CYP2A6ALDH1A1CYP1A2TSHRHSD17B10

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5354772-A Anticholesterol agents SANDOZ PHARM. CORP. (US) 1994-10-11 US disclosed
US-5001255-A Idene analogs of mevalonolactone and derivatives thereof SANDOZ PHARM. CORP. (US) 1991-03-19 US disclosed
US-4973704-A ANTICHOLESTEROL AGENTS SANDOZ PHARM. CORP. (US) 1990-11-27 US disclosed
EP-0235164-B1 IMIDAZOLE ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF SANDOZ AG (CH) 1990-07-25 EP disclosed
US-4876280-A ANTICHOLESTEROL AGENTS; ATHEROSCLEROSIS; ANTILIPEMICS SANDOZ PHARM. CORP. (US) 1989-10-24 US disclosed
EP-0327500-A2 5-Substituted 1H-pyrazolo[3,4-b]pyridine derivatives, their preparation and pharmaceutical compositions containing them SANDOZ AG (CH) 1989-08-09 EP disclosed
US-4851427-A INHJIBITORS OF CHOLESTEROL BIOSYNTHESIS SANDOZ PHARM. CORP. (US) 1989-07-25 US disclosed
US-4822799-A Pyrazolopyridine analogs of mevalonolactone and derivatives thereof useful for inhibiting cholesterol biosynthesis in mammals SANDOZ PHARM. CORP. (US) 1989-04-18 US disclosed
US-4808607-A ATHEROSCLEROSIS, HYPERLIPOPROTEINEMIA SANDOZ PHARM. CORP. (US) 1989-02-28 US disclosed
US-4804679-A INHIBIT CHOLESTEROL BIOSYNTHESIS SANDOZ PHARM. CORP. (US) 1989-02-14 US disclosed
US-4755606-A Imidazolyl-3,5-di-(diphenyl-butylsilyloxy) carboxylic acid ester intermediates SANDOZ PHARM. CORP. (US) 1988-07-05 US disclosed
US-4739073-A ANTICHOLESTEROL AGENTS SANDOZ PHARMACEUTICALS CORP. (US) 1988-04-19 US disclosed
EP-0114027-B1 ANALOGS OF MEVALOLACTONE AND DERIVATIVES THEREOF, PROCESSES FOR THEIR PRODUCTION, PHARMACEUTICAL COMPOSITIONS CONTAINING THEM AND THEIR USE AS PHARMACEUTICALS SANDOZ AG (CH) 1988-01-07 EP disclosed
EP-0235164-A1 IMIDAZOLE ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF. SANDOZ AG (CH) 1987-09-09 EP disclosed
US-4686237-A LOWERING BLOOD CHOLESTEROL LEVEL SANDOZ PHARMACEUTICALS CORP. (US) 1987-08-11 US disclosed
US-4668794-A CHOLESTEROL BIOSYNTHESIS INHIBITORS SANDOZ PHARM. CORP. (US) 1987-05-26 US disclosed
WO-1986007054-A1 IMIDAZOLE ANALOGS OF MEVALONOLACTONE AND DERIVATIVES THEREOF SANDOZ AG (CH) 1986-12-04 WO disclosed
US-4613610-A TREATING ATHEROSCLEROSIS AND HYPERLIPEMIA SANDOZ PHARMACEUTICALS CORP. (US) 1986-09-23 US disclosed