Thymine

Thymine

SCHEMBL31471702

Cc1c[nH]c(=O)[nH]c1=O.O=[N+]([O-])O

nearest known ligand 0.73

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

ERG11

The experimentally established mechanism targets of Thymine. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
ATAD2 Q6PL18 1/20 0.73
GAA P10253 2/20 0.45
ALDH1A1 P00352 3/20 0.44
LMNA P02545 2/20 0.44
KLF10 Q13118 1/20 0.44
DPYD Q12882 4/20 0.41
MAPT P10636 2/20 0.41
CYP19A1 P11511 1/20 0.41
TSHR P16473 1/20 0.41
THPO P40225 1/20 0.41
MTOR P42345 1/20 0.41
HTT P42858 1/20 0.41
HBB P68871 1/20 0.41
PMP22 Q01453 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
KDM4E B2RXH2 1/20 0.38
POLB P06746 2/20 0.36
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35

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
Thymine SCHEMBL23794979 0.86 ATAD2 (0.91) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL750450 0.85 ATAD2 (1.00) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL646138 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL31403209 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL6034999 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL23388801 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL2724033 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL4811815 0.83
Thymine SCHEMBL3500839 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD
Thymine SCHEMBL7043684 0.83 ATAD2 (0.95) ATAD2GAAALDH1A1LMNADPYD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250114390-A1 MULTI-ACTIVE TABLET IN THE TREATMENT AND CONTROL OF SEVERE CHRONIC PAIN AND METHOD OF PREPARATION LABORATORIOS SILANES, S.A. DE C.V. (MX) 2025-04-10 US disclosed
EP-4534077-A1 COMPOSITION COMPRISING CYANOCOBALAMIN, PYRIDOXINE, THIAMINE, PREGABALIN AND CELECOXIB Laboratorios Silanes, S.A. de C.V. (MX) 2025-04-09 EP disclosed