SCHEMBL7780995

SCHEMBL7780995

CC(=O)CCC(=O)[C@]1(O)C[C@H](n2cc(C)c(=O)[nH]c2=O)O[C@@H]1CO

nearest known ligand 0.49

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK1 P04183 5/20 0.45
LMNA P02545 3/20 0.45
ALB P02768 2/20 0.45
BLM P54132 2/20 0.45
ALDH1A1 P00352 1/20 0.45
POLB P06746 1/20 0.45
ADRA1A P35348 1/20 0.45
TK2 O00142 2/20 0.44
TSHR P16473 2/20 0.44
PKM P14618 1/20 0.44
PMP22 Q01453 1/20 0.44
CYP2D6 P10635 1/20 0.44

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
SCHEMBL551408 0.88 TK1 (0.49) TK1LMNAALBBLMALDH1A1
SCHEMBL8999390 0.87 TK2 (0.55) TK1LMNAALBBLMALDH1A1
SCHEMBL4077432 0.84 TK1 (0.46) TK1LMNAALBBLMALDH1A1
SCHEMBL7780993 0.83 TK2 (0.46) TK1LMNAALBBLMALDH1A1
SCHEMBL18670763 0.82 SLC28A1 (0.41)
SCHEMBL8999491 0.81 RNASE1 (0.55) TK1TK2
SCHEMBL6394877 0.80 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL5086587 0.80 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL13407948 0.80 TK1 (0.49) TK1LMNAALBBLMALDH1A1
SCHEMBL10892213 0.80 LMNA (0.49) TK1LMNAADRA1ATK2TSHR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0707591-B1 METHYLPHOSPHONIC ACID ESTER, PROCESS FOR PREPARING THE SAME AND ITS USE AVENTIS PHARMA GMBH (DE) 2001-09-26 EP disclosed
US-6028182-A Methylphosphonic acid esters, processes for their preparation, and their use HOECHST AKTIENGESELLSCHAFT (DE) 2000-02-22 US disclosed
US-5932718-A CONTACTING NUCLEOTIDE OR OLIGONUCLEOTIDE HAVING 5' H-PHOSPHONATE DERIVATIVE WITH 5'-O-TRITYL-3'-AMINO-2'-DEOXYRIBONUCLEOSIDE IN PRESENCE OF OXIDIZING AGENT PRODUCING PROTECTED INTERNUCLEOSIDE LINKAGE NORTHWESTERN UNIVERSITY (US) 1999-08-03 US disclosed
US-5648480-A Process for making oligonucleotides having modified internucleoside linkages NORTHWESTERN UNIVERSITY (US) 1997-07-15 US disclosed
US-5646260-A PHOSPHORYLATED OLIGONUCLEOTIDES LETSINGER ROBERT L (US) 1997-07-08 US disclosed
EP-0707591-A1 METHYLPHOSPHONIC ACID ESTER, PROCESS FOR PREPARING THE SAME AND ITS USE HOECHST AKTIENGESELLSCHAFT (DE) 1996-04-24 EP disclosed
US-5476925-A Antisense agents NORTHWESTERN UNIVERSITY (US) 1995-12-19 US disclosed
WO-1995001363-A1 METHYLPHOSPHONIC ACID ESTER, PROCESS FOR PREPARING THE SAME AND ITS USE HOECHST AKTIENGESELLSCHAFT (DE) 1995-01-12 WO disclosed
US-4973679-A Process for oligonucleo tide synthesis using phosphormidite intermediates UNIVERSITY PATENTS, INC. (US) 1990-11-27 US disclosed
US-4668777-A POLYNUCLEOTIDE INTERMEDIATES UNIVERSITY PATENTS, INC. (US) 1987-05-26 US disclosed
EP-0061746-B1 PHOSPHORAMIDITE COMPOUNDS AND THEIR USE IN PRODUCING OLIGONUCLEOTIDES UNIVERSITY PATENTS, INC. (US) 1985-03-20 EP disclosed
US-4415732-A STORAGE-STABLE NUCLEOSIDES; POLYNUCLEOTIDE SYNTHESIS UNIVERSITY PATENTS, INC. (US) 1983-11-15 US disclosed
EP-0061746-A1 Phosphoramidite compounds and their use in producing oligonucleotides UNIVERSITY PATENTS, INC. (US) 1982-10-06 EP disclosed