SCHEMBL867575

SCHEMBL867575

O=[N+]([O-])c1ccc(OP(=O)([O-])Oc2ccc([N+](=O)O)cc2)cc1

nearest known ligand 0.64

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 3/20 0.64
CA2 P00918 3/20 0.64
CES1 P23141 2/20 0.64
CES2 O00748 1/20 0.64
BCHE P06276 1/20 0.51
ACHE P22303 1/20 0.51
MAPK1 P28482 4/20 0.50
ALDH1A1 P00352 3/20 0.50
CYP3A4 P08684 2/20 0.50
HSD17B10 Q99714 2/20 0.50
LMNA P02545 2/20 0.50
TP53 P04637 1/20 0.50
THRB P10828 1/20 0.50
SMN1; SMN2 Q16637 1/20 0.50
TSHR P16473 1/20 0.46
MEN1 O00255 2/20 0.44
KMT2A Q03164 2/20 0.44
HSPB1 P04792 1/20 0.43
GAA P10253 1/20 0.42
AKR1C3 P42330 1/20 0.42

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
Water SCHEMBL9045485 0.98 CA1 (0.62) CA1CA2CES1CES2BCHE
SCHEMBL11588710 0.98 CA1 (0.62) CA1CA2CES1CES2BCHE
SCHEMBL11588707 0.89 CA1 (0.67) CA1CA2CES1CES2BCHE
SCHEMBL4609079 0.89 CA1 (0.67) CA1CA2CES1CES2BCHE
SCHEMBL4918240 0.81 CA1 (0.53) CA1CA2CES1CES2BCHE
SCHEMBL35321 0.80 CA1 (0.55) CA1CA2CES1CES2BCHE
P-Nitrophenylphosphate SCHEMBL168768 0.80 CA1 (0.69) CA1CA2CES1CES2BCHE
SCHEMBL11322611 0.79 CA1 (0.53) CA1CA2CES1CES2BCHE
P-Nitrophenylphosphate SCHEMBL6681723 0.79 CA1 (0.73) CA1CA2CES1CES2BCHE
SCHEMBL3733671 0.79 CA1 (0.53) CA1CA2CES1CES2BCHE

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2025007970-A1 REGENERATION TREATMENT METHOD FOR DEGRADABLE HIGH POLYMER MATERIAL AND USE 复旦大学 2025-01-09 WO claimed
CN-117106852-B Detection method for rapidly detecting agricultural product pesticide residues and application thereof 济宁市兖州区检验检测中心 2024-03-19 CN claimed
CN-117106852-A Detection method for rapidly detecting agricultural product pesticide residues and application thereof 济宁市兖州区检验检测中心 2023-11-24 CN claimed
CN-114100690-A Bionic catalyst for preparing nuclease by utilizing porous nano material 南开大学 2022-03-01 CN claimed
CN-107602643-B Naphthalimide-based β -glucuronidase fluorescent probe and application thereof 王铮 2020-06-30 CN claimed
EP-3206723-A1 BIOLOGICAL INDICATOR American Sterilizer Company (US) 2017-08-23 EP claimed
US-9701968-B2 Biological indicator AMERICAN STERILIZER COMPANY (US) 2017-07-11 US claimed
US-20160312263-A1 BIOLOGICAL INDICATOR AMERICAN STERILIZER CO (US) 2016-10-27 US claimed
WO-2016060714-A1 BIOLOGICAL INDICATOR AMERICAN STERILIZER COMPANY (US) 2016-04-21 WO claimed
US-20160102335-A1 BIOLOGICAL INDICATOR AMERICAN STERILIZER COMPANY 2016-04-14 US claimed
US-8507248-B2 Genetically engineered biological indicator AMERICAN STERILIZER COMPANY (US) 2013-08-13 US claimed
US-8173389-B2 Process for determining the effectiveness of a sterilization AMERICAN STERILIZER COMPANY (US) 2012-05-08 US claimed
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
US-20090117603-A1 STERILIZATION INDICATOR FRANCISKOVICH PHILLIP P 2009-05-07 US 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-20080070231-A1 Reporter genes taken up by microorganism, and repressor gene inhibits expression AMERICAN STERILIZER COMPANY 2008-03-20 US claimed
US-20080070272-A1 STERILIZATION INDICATOR AMERICAN STERILIZER COMPANY 2008-03-20 US claimed