SCHEMBL5081573

SCHEMBL5081573

O=C(O)c1cccc(S(=O)(=O)O)c1[N+](=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.47
POLB P06746 1/20 0.47
ALDH1A1 P00352 3/20 0.44
CYP1A2 P05177 1/20 0.44
CYP2D6 P10635 1/20 0.44
CYP2C19 P33261 1/20 0.44
ALOX15 P16050 2/20 0.42
CA1 P00915 1/20 0.42
CA2 P00918 1/20 0.42
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP9 P14780 1/20 0.42
MMP8 P22894 1/20 0.42
MMP13 P45452 1/20 0.42
SMN1; SMN2 Q16637 1/20 0.40
TDP1 Q9NUW8 1/20 0.39
F2 P00734 1/20 0.39
PRSS1 P07477 1/20 0.39
PRSS2 P07478 1/20 0.39
PRSS3 P35030 1/20 0.39

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
SCHEMBL27861590 1.00 TSHR (0.47) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL3069224 0.87 ALDH1A1 (0.40) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL27936141 0.86 ALDH1A1 (0.43) POLBALDH1A1CYP1A2CA1CA2
SCHEMBL22714781 0.85 ALDH1A1 (0.47) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL29631212 0.85 ALDH1A1 (0.47) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL16993599 0.85 TSHR (0.50) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL16993597 0.85 TSHR (0.50) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL27604428 0.84 ALDH1A1 (0.45) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL9500972 0.82 TSHR (0.47) TSHRPOLBALDH1A1CYP1A2CYP2D6
SCHEMBL27714239 0.81 LMNA (0.41) POLBALDH1A1CYP1A2CYP2D6CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102094068-B Method for detecting activity of methionine sulfoxide reductase and medicine screening kit UNIV HUAZHONG SCIENCE TECH 2013-07-31 CN claimed
CN-102596182-A Use of biocompatible compositions and materials polymerized therefrom for inhibiting angiogenesis NMI UNIV TUEBINGEN 2012-07-18 CN claimed
CN-102124337-A Device for rapid determination of disease-associated thiol compounds ALT BIOSCIENCE LLC 2011-07-13 CN claimed
CN-102094068-A Method for detecting activity of methionine sulfoxide reductase and medicine screening kit UNIV HUAZHONG SCIENCE TECH 2011-06-15 CN claimed
US-4211723-A PHOSGENE, SULFOBENZOIC ACID, DIMETHYLFORMAMIDE IHARA CHEMICAL INDUSTRY CO., LTD. (JP) 1980-07-08 US claimed
CN-103298937-B Multispecific antigen-binding molecules having a function replacing the function of factor VIII CHUGAI PHARMACEUTICAL CO.,LTD. (JP) 2016-05-25 CN disclosed
CN-204924926-U Gamma - glutamy transpeptidase detect reagent box SHANGHAI ZHICHENG BIOLOG TECHNOLOGY CO LTD 2015-12-30 CN disclosed
CN-104856191-A Low-temperature quick-freezing and partial-freezing solution for food and use method of low-temperature quick-freezing and partial-freezing solution LIN QIAOZHEN 2015-08-26 CN disclosed
CN-102124337-B Device for rapid determination of disease-associated thiol compounds ALT BIOSCIENCE LLC 2015-06-10 CN disclosed
CN-104098699-A PRLR-specific antibody and uses thereof XOMA TECHNOLOGY LTD 2014-10-15 CN disclosed
CN-104059149-A Anti-C5aR antibodies with improved properties G2 INFLAMMATION PTY LTD 2014-09-24 CN disclosed
CN-104059143-A Compositions and methods for treatment and diagnosis of influenza THERACLONE SCIENCES INC 2014-09-24 CN disclosed
EP-1274672-A1 METHOD FOR PRODUCING SUBSTITUTED NITRO BENZOIC ACIDS BY OXIDATION OF CORRESPONDING NITRO TOLUENES, NITRO BENZYL ALCOHOLS, ESTERS AND/OR ETHERS Bayer Aktiengesellschaft (DE) 2003-01-15 EP disclosed
WO-2001079151-A1 METHOD FOR PRODUCING SUBSTITUTED NITRO BENZOIC ACIDS BY OXIDATION OF CORRESPONDING NITRO TOLUENES, NITRO BENZYL ALCOHOLS, ESTERS AND/OR ETHERS BAYER AKTIENGESELLSCHAFT (DE) 2001-10-25 WO disclosed
CN-1259962-A Anti-vegf antibodies GENENTECH INC (US) 2000-07-12 CN disclosed
CN-1214695-A Erdb3 antibody GENENTECH INC (US) 1999-04-21 CN disclosed
CN-1186517-A Altered polypeptides with increased half-life GENENTECH INC (US) 1998-07-01 CN disclosed
CN-1176659-A A method for making heteromultimeric polypeptides GENENTECH INC (US) 1998-03-18 CN disclosed
US-5565608-A Process for the preparation of 2-(substituted)-4-sulfobenzoic acid ZENECA LIMITED (GB) 1996-10-15 US disclosed
CN-1087642-A Be used to discharge the method for cytotoxic agents and its component HYBRITECH INC (US) 1994-06-08 CN disclosed