SCHEMBL2912500

SCHEMBL2912500

CC(C)(C)[Si](OCC1(Cc2ccccc2)CC1)(c1ccccc1)c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
OPRL1 P41146 4/20 0.38
OPRM1 P35372 3/20 0.38
MAOA P21397 1/20 0.35
MAOB P27338 1/20 0.35
SMYD2 Q9NRG4 3/20 0.35
CYP3A4 P08684 1/20 0.35
HTT P42858 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
GAA P10253 3/20 0.33
LMNA P02545 1/20 0.33
MEN1 O00255 2/20 0.33
KMT2A Q03164 2/20 0.33
POLB P06746 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.32
OPRK1 P41145 1/20 0.31
PSMB5 P28074 1/20 0.31

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
SCHEMBL4121310 0.87 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2PSMB5
SCHEMBL29583645 0.85 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; SMN2MEN1
SCHEMBL20446429 0.84 SMYD2 (0.35) MAOAMAOBSMYD2CYP3A4HTT
SCHEMBL31163018 0.84 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL2912786 0.84 SMYD2 (0.38) OPRL1OPRM1SMYD2CYP3A4HTT
SCHEMBL4127698 0.84 SMYD2 (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL29235827 0.81 SMYD2 (0.34) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL29235511 0.81 SMYD2 (0.34) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL29597845 0.80 SYK (0.35) SMYD2CYP3A4HTTSMN1; SMN2
SCHEMBL29598242 0.80 SMYD2 (0.36) SMYD2CYP3A4HTTSMN1; 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1358198-B1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2010-08-25 EP disclosed
EP-1358198-A4 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD (KR) 2008-03-05 EP disclosed
EP-1358198-A1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG Chem Investment, Ltd. (KR) 2003-11-05 EP disclosed
WO-2002057288-A1 NOVEL ACYCLIC NUCLEOSIDE PHOSPHONATE DERIVATIVES, SALTS THEREOF AND PROCESS FOR THE PREPARATION OF THE SAME LG LIFE SCIENCES LTD. (KR) 2002-07-25 WO disclosed