SCHEMBL551408

SCHEMBL551408

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

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TK1 P04183 5/20 0.49
LMNA P02545 3/20 0.49
ALB P02768 2/20 0.49
BLM P54132 2/20 0.49
ALDH1A1 P00352 1/20 0.49
POLB P06746 1/20 0.49
ADRA1A P35348 1/20 0.49
TSHR P16473 2/20 0.47
PKM P14618 1/20 0.47
PMP22 Q01453 1/20 0.47
CYP2D6 P10635 1/20 0.47
RNASE1 P07998 1/20 0.46

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
SCHEMBL4077432 0.89 TK1 (0.46) TK1LMNAALBBLMALDH1A1
SCHEMBL7780995 0.88 TK1 (0.45) TK1LMNAALBBLMALDH1A1
SCHEMBL6374108 0.88 LMNA (0.53) TK1LMNAADRA1ATSHRPMP22
SCHEMBL11343250 0.88 TK2 (0.47) TK1
SCHEMBL8075152 0.85 TK1 (0.44) TK1RNASE1
SCHEMBL8999491 0.85 RNASE1 (0.55) TK1RNASE1
SCHEMBL6394877 0.85 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL5086587 0.85 LMNA (0.52) TK1LMNAALBBLMALDH1A1
SCHEMBL6934554 0.84 TK1 (0.45) TK1RNASE1
SCHEMBL23882937 0.84 LMNA (0.51) TK1LMNAALBBLMALDH1A1

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 68 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-59141591-A None JP disclosed
JP-59141590-A None JP disclosed
US-11161869-B2 Thermally-cleavable protecting and linker groups EVONETIX LTD. (GB) 2021-11-02 US disclosed
US-20210107934-A1 THERMALLY-CLEAVABLE PROTECTING AND LINKER GROUPS SILICON VALLEY BANK 2021-04-15 US disclosed
EP-3609866-A1 THERMALLY-CLEAVABLE PROTECTING AND LINKER GROUPS Evonetix Ltd (GB) 2020-02-19 EP disclosed
WO-2018189546-A1 THERMALLY-CLEAVABLE PROTECTING AND LINKER GROUPS EVONETIX LTD (GB) 2018-10-18 WO disclosed
EP-2580198-B1 THERMOLABILE 2-(N-2-PYRIDIYL-N-BENZYL)-AMINOETHYLOXYCARBONYL DERIVATIVES AS HYDROXYL FUNCTION PROTECTING AGENTS INST CHEMII BIOORG POLSKIEJ AKADEMII NAUK (PL) 2016-08-10 EP disclosed
US-8759509-B2 Way of using thermolabile groups to protect hydroxyl functions and compounds for implementing the procedure INSTYTUT CHEMII BIOORGANICZNEJ POLSKIEJ AKADEMII NAUK (PL) 2014-06-24 US disclosed
US-20130085272-A1 NEW WAY OF USING THERMOLABILE GROUPS TO PROTECT HYDROXYL FUNCTIONS, AND NEW COMPOUNDS FOR IMPLEMENTING THE PROCEDURE INSTYTUT CHEMII BIOORGANICZNEJ POLSKIEJ AKADEMII NAUK (PL) 2013-04-04 US disclosed
US-8268318-B2 Polyalkylene oxides having hindered ester-based biodegradable linkers ENZON PHARMACEUTICALS, INC. (US) 2012-09-18 US disclosed
WO-1992020650-A2 PHOSPHITE-BORANE COMPOUNDS, AND METHOD OF MAKING AND USING THE SAME BORON BIOLOGICALS, INC. (US) 1992-11-26 WO disclosed
US-5143907-A Antitumor and antiinflammatory agents, hypolipidemic activity BORON BIOLOGICALS, INC. (US) 1992-09-01 US disclosed
US-5138045-A POLYAMINE CONJUGATED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS (US) 1992-08-11 US disclosed
WO-1992002531-A1 NOVEL POLYAMINE CONJUGATED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 1992-02-20 WO disclosed
EP-0460045-A1 NUCLEOSIDE ANALOGUES UNIVERSITY COLLEGE LONDON (GB) 1991-12-11 EP disclosed
WO-1991008213-A1 OLIGORIBONUCLOSIDE AND OLIGODEOXYRIBONUCLEOSIDE BORANOPHOSPHATES BORON BIOLOGICALS, INC. (US) 1991-06-13 WO disclosed
WO-1991004983-A1 NUCLEOSIDE AND POLYNUCLEOTIDE THIOPHOSPHORAMIDITE AND PHOSPHORODITHIOATE COMPOUNDS AND PROCESSES UNIVERSITY PATENTS, INC. (US) 1991-04-18 WO disclosed
WO-1990010012-A1 NUCLEOSIDE ANALOGUES UNIVERSITY COLLEGE LONDON (GB) 1990-09-07 WO disclosed
JP-S59141590-A PREPARATION OF AMMONIUM (5-IODO-3-INDOLYL) 5'-THYMIDYLATE FUJIREBIO INC 1984-08-14 JP disclosed
JP-S59141591-A PREPARATION OF AMMONIUM (5-IODO-3-INDOLYL) 5'-THYMIDYLATE FUJIREBIO INC 1984-08-14 JP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20210107934-A1 THERMALLY-CLEAVABLE PROTECTING AND LINKER GROUPS CTDSP1, RNGTT, SSU72 TK1 152/4885LMNA 311/4885ALB 3912/4885
US-20130085272-A1 NEW WAY OF USING THERMOLABILE GROUPS TO PROTECT HYDROXYL FUNCTIONS, AND NEW COMPOUNDS FOR IMPLEMENTING THE PROCEDURE RNGTT, POLB, UNG TK1 238/4885LMNA 320/4885ALB 3932/4885
US-11161869-B2 Thermally-cleavable protecting and linker groups CTDSP1, RNGTT, SSU72 TK1 152/4885LMNA 311/4885ALB 3912/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.