SCHEMBL11044896

SCHEMBL11044896

CCOc1ccccc1C(C#N)O[Si](C)(C)C

nearest known ligand 0.40

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.40
L3MBTL1 Q9Y468 4/20 0.39
MAPT P10636 2/20 0.39
NPSR1 Q6W5P4 2/20 0.39
PKM P14618 1/20 0.38
KDM4E B2RXH2 3/20 0.38
PPARG P37231 1/20 0.38
STAT3 P40763 1/20 0.38
NCOA2 Q15596 1/20 0.38
RXFP1 Q9HBX9 1/20 0.38
SGMS2 Q8NHU3 5/20 0.37
LMNA P02545 3/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
ALOX15 P16050 2/20 0.37
BRCA1 P38398 1/20 0.37
HBB P68871 1/20 0.37
HSD17B10 Q99714 1/20 0.37
POLB P06746 1/20 0.36
ATM Q13315 1/20 0.36

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
SCHEMBL11039723 0.85 SGMS2 (0.54) ALDH1A1L3MBTL1MAPTKDM4ESGMS2
SCHEMBL11042257 0.85 ALDH1A1 (0.42) ALDH1A1L3MBTL1MAPTNPSR1KDM4E
SCHEMBL9827673 0.84 ALDH1A1 (0.33) ALDH1A1SGMS2LMNA
SCHEMBL11637673 0.82 ALDH1A1 (0.43) ALDH1A1L3MBTL1MAPTNPSR1PKM
SCHEMBL11040633 0.80 L3MBTL1 (0.41) ALDH1A1L3MBTL1MAPTNPSR1PKM
SCHEMBL11040700 0.80 GAA (0.42) MAPTKDM4EPOLBCYP1A2
SCHEMBL1825768 0.78 CA1 (0.33)
SCHEMBL11040594 0.77 ALOX5 (0.40) ALDH1A1L3MBTL1NPSR1KDM4ELMNA
SCHEMBL2610140 0.77 ESR1 (0.42) ALDH1A1MAPTNPSR1SGMS2LMNA
SCHEMBL3295518 0.76 ALDH1A1 (0.36) ALDH1A1L3MBTL1MAPTPKMKDM4E

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-4448971-A Hypoglycemic 5-phenyl-substituted oxazolidine-2,4-diones PFIZER INC. (US) 1984-05-15 US disclosed
US-4407811-A Hypoglycemic 5-substituted oxazolidine-2,4-diones PFIZER INC. (US) 1983-10-04 US disclosed
US-4399296-A TRIMETHYLSILYL CYANOHYDRIN INTERMEDIATES PFIZER INC. (US) 1983-08-16 US disclosed
US-4367234-A HYPOGLYCEMIC AGENTS PFIZER INC. (US) 1983-01-04 US disclosed