SCHEMBL2347136

SCHEMBL2347136

O=C1c2cccc([N+](=O)[O-])c2C(=O)c2cccc([N+](=O)[O-])c21

nearest known ligand 0.84

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
S100A4 P26447 2/20 0.84
PTPRC P08575 1/20 0.75
CSNK2A2 P19784 1/20 0.62
CSNK2B P67870 1/20 0.62
CSNK2A1 P68400 1/20 0.62
CSNK2A3 Q8NEV1 1/20 0.62
MAPT P10636 2/20 0.61
RECQL P46063 1/20 0.61
KMT2A Q03164 1/20 0.61
MCL1 Q07820 1/20 0.61
RXFP1 Q9HBX9 1/20 0.61
POLB P06746 1/20 0.58
APEX1 P27695 1/20 0.58
CASP6 P55212 1/20 0.58
CA1 P00915 1/20 0.58
CA2 P00918 1/20 0.58
CA7 P43166 1/20 0.58
CA9 Q16790 1/20 0.58
LCK P06239 2/20 0.54
TDP1 Q9NUW8 3/20 0.52

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
SCHEMBL11317413 0.96 S100A4 (0.78) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
SCHEMBL156735 0.94 S100A4 (0.79) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
Anthraquinone SCHEMBL27736010 0.94 S100A4 (0.79) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
SCHEMBL11210972 0.94 S100A4 (0.75) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
SCHEMBL1303600 0.94 S100A4 (0.81) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
SCHEMBL27694074 0.92 S100A4 (0.77) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
Water SCHEMBL11135902 0.92 S100A4 (0.77) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
Ammonia Solution, Strong SCHEMBL27539963 0.92 S100A4 (0.77) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
SCHEMBL28651375 0.91 S100A4 (0.92) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1
SCHEMBL9257330 0.91 S100A4 (0.77) S100A4PTPRCCSNK2A2CSNK2BCSNK2A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-221907008-U System for simultaneously synthesizing 1, 5-diaminoanthraquinone and aniline 山东科加工业技术研究院有限公司 2024-10-29 CN claimed
CN-111423329-B Resource utilization method of waste residues generated in production of 1-nitroanthraquinone by solvent method 九江富达实业有限公司 2024-04-26 CN claimed
CN-114276357-B 2,8, 14-trinitro substituted hexaazanaphthalene monomer and azo-based polymer thereof, preparation method and application 吉林大学 2023-03-28 CN claimed
CN-114276357-A 2,8, 14-trinitro substituted hexaazanaphthalene monomer and azo-based polymer thereof, preparation method and application 吉林大学 2022-04-05 CN claimed
CN-112390720-B Method for synthesizing 1, 5-dinitroanthraquinone by continuous flow microchannel reactor 徐州工业职业技术学院 2022-03-04 CN claimed
CN-112390720-A Method for synthesizing 1, 5-dinitroanthraquinone by continuous flow microchannel reactor 徐州工业职业技术学院 2021-02-23 CN claimed
CN-111454158-A Method for co-producing dinitroanthraquinone with 1-nitroanthraquinone 九江富达实业有限公司 2020-07-28 CN claimed
CN-111423329-A Resource utilization method of waste residue generated in production of 1-nitroanthraquinone by solvent method 九江富达实业有限公司 2020-07-17 CN claimed
CN-107446381-A The method that nitrating wasting acid of Disperse Blue-56 recycles 青岛海湾集团有限公司 2017-12-08 CN claimed
CN-101391963-B Method for comprehensively utilizing 1-nitroanthraquinone waste residue UNIV SHANDONG 2012-04-25 CN claimed
US-4014906-A Process for the manufacture of anthraquinone compounds CIBA-GEIGY CORPORATION (US) 1977-03-29 US claimed
US-4006171-A FROM NITROANTHRAQUINONE AND HALOGEN BAYER AKTIENGESELLSCHAFT (DT) 1977-02-01 US claimed
US-3996252-A Preparation of pure 1,8-dinitroanthraquinone BAYER AKTIENGESELLSCHAFT (DT) 1976-12-07 US claimed
US-3996251-A Preparation of pure 1,5-dinitroanthraquinone BAYER AKTIENGESELLSCHAFT (DT) 1976-12-07 US claimed
US-3983145-A Use of alpha-di(lower alkoxy) anthraquinones in the synthesis of Alizarin Saphirols TOMS RIVER CHEMICAL CORPORATION (US) 1976-09-28 US claimed
US-3966774-A Process for the production of amino-anthraquinone SANDOZ LTD. (CH) 1976-06-29 US claimed
US-3963762-A Process for producing 1,5-dinitroanthraquinone and 1,8-dinitroanthraquinone BAYER AKTIENGESELLSCHAFT (DT) 1976-06-15 US claimed
US-3963761-A NITRATING AN ANTHRAQUINONE BAYER AKTIENGESELLSCHAFT (DT) 1976-06-15 US claimed
US-3939185-A Process for the preparation of 1-nitro-anthraquinone which is practically free of 1,5-dinitro-anthraquinone BAYER AKTIENGESELLSCHAFT (DT) 1976-02-17 US claimed
US-3931253-A FROM A NITROANTHRAQUINONE, HYDROGENATION, RANEY CATALYST SANDOZ LTD., (SANDOZ AG) (CH) 1976-01-06 US claimed