SCHEMBL30583147

SCHEMBL30583147

Cc1cn([C@@]2(N=[N+]=[N-])CC[C@@H](COP(=O)(O)OP(=O)(O)O)O2)c(=O)[nH]c1=O

nearest known ligand 0.51

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.51
POLA1 P09884 1/20 0.51
POLD1 P28340 1/20 0.51
TK1 P04183 5/20 0.42
P2RY6 Q15077 6/20 0.41
P2RY2 P41231 1/20 0.41
ALB P02768 1/20 0.36
PKM P14618 1/20 0.36
LMNA P02545 1/20 0.36
BLM P54132 1/20 0.36
PMP22 Q01453 1/20 0.36

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
SCHEMBL29625276 0.98 POLB (0.53) POLBPOLA1POLD1TK1P2RY6
SCHEMBL15515984 0.83 POLB (0.56) POLBPOLA1POLD1TK1P2RY6
SCHEMBL28767348 0.83 TK1 (0.44) POLBTK1ALBPKMLMNA
SCHEMBL26119686 0.80 POLB (0.48) POLBPOLA1POLD1TK1P2RY6
SCHEMBL4440836 0.79 POLB (0.47) POLBPOLA1POLD1TK1P2RY6
SCHEMBL599227 0.79 POLB (0.47) POLBPOLA1POLD1TK1P2RY6
Triphosphate SCHEMBL27823972 0.78 POLB (0.46) POLBPOLA1POLD1TK1P2RY6
SCHEMBL17515060 0.76 TK1 (0.51) POLBPOLA1POLD1TK1
SCHEMBL7240891 0.73 POLB (0.52) POLBPOLA1POLD1TK1P2RY6
SCHEMBL9392106 0.72 POLA1 (0.51) POLBPOLA1POLD1TK1P2RY6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3681504-B1 METHODS OF DETECTION USING X-RAY FLUORESCENCE ICAGEN INC (US) 2023-08-23 EP disclosed