SCHEMBL4809531

SCHEMBL4809531

Cc1cn([C@@]2(O)C[C@H](O)[C@@H](CO)O2)c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TK1 P04183 6/20 0.44
LMNA P02545 3/20 0.41
ALB P02768 2/20 0.41
BLM P54132 2/20 0.41
ALDH1A1 P00352 1/20 0.41
POLB P06746 1/20 0.41
ADRA1A P35348 1/20 0.41
TSHR P16473 2/20 0.40
PKM P14618 1/20 0.40
PMP22 Q01453 1/20 0.40
CYP2D6 P10635 1/20 0.40

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
SCHEMBL29364921 0.86 TK1 (0.45) TK1LMNAALBBLMALDH1A1
SCHEMBL20526458 0.85 PYGM (0.46) TK1LMNABLMALDH1A1POLB
SCHEMBL8110184 0.85 LMNA (0.51) TK1LMNABLMADRA1ATSHR
SCHEMBL135210 0.85 TK1 (0.44) TK1LMNAALBBLMALDH1A1
SCHEMBL16187026 0.85 TK1 (0.44) TK1LMNAALBBLMALDH1A1
SCHEMBL4542149 0.84 TK1 (0.43) TK1LMNAALBBLMALDH1A1
SCHEMBL5849101 0.84 TK1 (0.43) TK1LMNAALBBLMALDH1A1
SCHEMBL7537552 0.84 TK1 (0.43) TK1LMNAALBBLMALDH1A1
SCHEMBL660497 0.84 TK1 (0.45) TK1LMNAALBBLMALDH1A1
SCHEMBL2294 0.84 TK1 (0.43) 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 8 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115916994-A Detection of methylcytosine and its derivatives using S-adenosyl-L-methionine analogue (xSAM) 伊鲁米那股份有限公司 2023-04-04 CN claimed
CN-115916994-A Detection of methylcytosine and its derivatives using S-adenosyl-L-methionine analogue (xSAM) 伊鲁米那股份有限公司 2023-04-04 CN disclosed
CN-101769930-A Applying method for fluoric compound in identifying circulatory tumor cells XIAOMING LU 2010-07-07 CN disclosed
US-7419653-B2 Method for preparing radiolabeled thymidine having low chromophoric byproducts SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2008-09-02 US disclosed
US-20070077198-A1 Method for preparing radiolabeled thymidine having low chromophoric byproducts WALSH JOSEPH C 2007-04-05 US disclosed
US-7160537-B2 Method for preparing radiolabeled thymidine having low chromophoric byproducts SIEMENS MEDICAL SOLUTIONS USA, INC. (US) 2007-01-09 US disclosed
WO-2005058247-A2 METHOD FOR PREPARING RADIOLABELED THYMIDINE HAVING LOW CHROMOPHORIC BYPRODUCTS MOLECULAR TECHNOLOGIES, INC. (US) 2005-06-30 WO disclosed
US-20050131223-A1 Method for preparing radiolabeled thymidine having low chromophoric byproducts CTI PET SYSTEMS, INC. 2005-06-16 US 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 (2 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-20050131223-A1 Method for preparing radiolabeled thymidine having low chromophoric byproducts TYMP, TYMS, FLT1 TK1 5/4885LMNA 1130/4885ALB 2152/4885
US-20070077198-A1 Method for preparing radiolabeled thymidine having low chromophoric byproducts TYMP, TYMS, FLT1 TK1 5/4885LMNA 1130/4885ALB 2152/4885

“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.