SCHEMBL7898284

SCHEMBL7898284

COC(=O)C(O)CO[Si](c1ccccc1)(c1ccccc1)C(C)(C)C

nearest known ligand 0.47

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 3/20 0.39
ADRB2 P07550 4/20 0.39
ADRB1 P08588 4/20 0.39
ADRB3 P13945 4/20 0.39
CYP3A4 P08684 1/20 0.36
HTT P42858 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
TSHR P16473 2/20 0.34
ALDH1A1 P00352 3/20 0.34
MAPT P10636 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
MEN1 O00255 1/20 0.34
LMNA P02545 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
SCHEMBL839988 0.88 CYP3A4 (0.38) KMT2AADRB2ADRB1ADRB3CYP3A4
SCHEMBL839989 0.88 CYP3A4 (0.38) KMT2AADRB2ADRB1ADRB3CYP3A4
SCHEMBL29288420 0.87 PTPRA (0.37) ADRB2ADRB1ADRB3CYP3A4HTT
SCHEMBL18302874 0.87 PTPRA (0.37) ADRB2ADRB1ADRB3CYP3A4HTT
SCHEMBL734737 0.86 CYP3A4 (0.40) KMT2AADRB2ADRB1ADRB3CYP3A4
SCHEMBL5873084 0.86 ESRRB (0.39) KMT2AADRB2ADRB1ADRB3CYP3A4
SCHEMBL5685142 0.86 ESRRB (0.39) KMT2AADRB2ADRB1ADRB3CYP3A4
SCHEMBL5685150 0.86 ESRRB (0.39) KMT2AADRB2ADRB1ADRB3CYP3A4
SCHEMBL25252674 0.85 ALDH1A1 (0.43) KMT2AADRB2ADRB1ADRB3SMN1; SMN2
SCHEMBL19458945 0.85 ALDH1A1 (0.43) KMT2AADRB2ADRB1ADRB3SMN1; SMN2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-6194576-B1 COUPLING PURINE OR PYRIMIDINE BASE WITH NUCLEOTIDE ANALOG PHOSPHONATE COMPOUND BIOCHEM PHARMA, INC. (CA) 2001-02-27 US disclosed
US-6127540-A NUCLEOTIDE ANALOGS MADE BY COUPLING A PURINE OR PYRIMIDINE NUCLEOTIDE BASE OR ANALOGUE THEREOF WITH A 2-(PHOSPHONATE)FURAN OR 2-(PHOSPHONATE)THIOFURAN OF GIVEN FORMULA; USE AS NON-TOXIC ANTIVIRAL DRUGS BIOCHEM PHARMA, INC. (CA) 2000-10-03 US disclosed
US-6005107-A Antiviral compounds BIOCHEM PHARMA, INC. (CA) 1999-12-21 US disclosed
US-5955610-A COUPLING PHOSPHONATE INTERMEDIATE WITH PURINE OR PYRIMIDINE NUCLEOTIDE BASE BIOCHEM PHARMA, INC. (CA) 1999-09-21 US disclosed
US-5789394-A VIRICIDES FOR CYTOMEGALOVIRUS USING NUCLEOTIDES NGUYEN-BA NGHE (CA) 1998-08-04 US disclosed