SCHEMBL548542

SCHEMBL548542

Cc1cn([C@H]2C[C@H](OP(=O)(O)O)[C@@H](COc3ccc([N+](=O)[O-])cc3)O2)c(=O)[nH]c1=O

nearest known ligand 0.54

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
TYMS P04818 2/20 0.54
TK1 P04183 4/20 0.51
POLB P06746 2/20 0.48
RNASE1 P07998 1/20 0.47
POLA1 P09884 1/20 0.45
POLD1 P28340 1/20 0.45

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
SCHEMBL1255504 0.88 TK1 (0.56) TYMSTK1POLBRNASE1POLA1
SCHEMBL2543582 0.87 TYMS (0.63) TYMSTK1POLB
SCHEMBL8515502 0.85 TK1 (0.50) TYMSTK1POLBRNASE1POLA1
SCHEMBL8424441 0.85 RNASE1 (0.53) TYMSTK1RNASE1
SCHEMBL288740 0.82 TK1 (0.74) TYMSTK1POLBPOLA1POLD1
SCHEMBL21068055 0.82 TK1 (0.74) TYMSTK1POLBPOLA1POLD1
SCHEMBL7038209 0.82 TK1 (0.74) TYMSTK1POLBPOLA1POLD1
SCHEMBL7243145 0.82 TK1 (0.62) TK1POLBRNASE1POLA1POLD1
SCHEMBL3063249 0.80 TYMS (0.68) TYMSTK1POLB
SCHEMBL8428624 0.80 TYMS (0.68) TYMSTK1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100267044-A1 GENETICALLY ENGINEERED BIOLOGICAL INDICATOR FRANCISKOVICH PHILLIP P 2010-10-21 US claimed
EP-2084294-A2 STERILIZATION INDICATOR American Sterilizer Company (US) 2009-08-05 EP claimed
EP-2084293-A2 GENETICALLY ENGINEERED BIOLOGICAL INDICATOR American Sterilizer Company (US) 2009-08-05 EP claimed
WO-2008082728-A2 STERILIZATION INDICATOR AMERICAN STERILIZER COMPANY (US) 2008-07-10 WO claimed
WO-2008079469-A2 GENETICALLY ENGINEERED BIOLOGICAL INDICATOR AMERICAN STERILIZER COMPANY (US) 2008-07-03 WO claimed
US-6787327-B2 ENCODED BY ISOLATED NUCLEIC ACID; HIGH THROUGHPUT ENZYMATIC ASSAY; SCREENING FOR MODULATORS OF ENZYMATIC ACTIVITY KELK GRADUATE OF APPLIED LIFE SCIENCES 2004-09-07 US claimed
US-20030124587-A1 Human tyrosine-DNA phosphodiesterase variant polypeptides and methods of use therefor KECK GRADUATE INSTITUTE OF APPLIED LIFE SCIENCES 2003-07-03 US claimed
WO-2003031579-A2 HUMAN TYROSINE-DNA PHOSPHODIESTERASE VARIANT POLYPEPTIDES AND METHODS OF USE THEREFOR KECK GRADUATE INSTITUTE OF APPLIED LIFE SCIENCES (US) 2003-04-17 WO claimed
CN-112930397-B ENPP1 polypeptides and methods of use thereof 耶鲁大学 2025-05-09 CN disclosed
US-12024700-B2 Biological disinfection or sterilization indicator TERRAGENE LLC (US) 2024-07-02 US disclosed
CN-113993993-A ENPP1 polypeptides and methods of use thereof 耶鲁大学 2022-01-28 CN disclosed
US-20210179998-A1 BIOLOGICAL DISINFECTION OR STERILIZATION INDICATOR TERRAGENE LLC (US) 2021-06-17 US disclosed
CN-112930397-A ENPP1 polypeptides and methods of use thereof 耶鲁大学 2021-06-08 CN disclosed
US-11001799-B2 Biological disinfection or sterilization indicator TERRAGENE LLC (US) 2021-05-11 US disclosed
WO-2003031579-A2 HUMAN TYROSINE-DNA PHOSPHODIESTERASE VARIANT POLYPEPTIDES AND METHODS OF USE THEREFOR KECK GRADUATE INSTITUTE OF APPLIED LIFE SCIENCES (US) 2003-04-17 WO disclosed
EP-0371682-B1 Rapid method for determining efficacy of a sterilization cycle and rapid read-out biological indicator MINNESOTA MINING & MFG (US) 1996-05-22 EP disclosed
US-5418167-A Sterilization indicator MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1995-05-23 US disclosed
US-5252484-A Determination of efficiency of sterilization cycle MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-10-12 US disclosed
US-5223401-A Colorimetric analysis; substrate system producing detectable enzyme-modified product MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1993-06-29 US disclosed
US-5073488-A Using active enzyme MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1991-12-17 US disclosed