SCHEMBL6136134

SCHEMBL6136134

O=[N+]([O-])c1cccc(Oc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.51
MEN1 O00255 2/20 0.51
KMT2A Q03164 2/20 0.51
TTR P02766 1/20 0.51
ALB P02768 1/20 0.51
THRB P10828 1/20 0.51
ALDH1A1 P00352 2/20 0.49
TSHR P16473 1/20 0.49
GPR35 Q9HC97 1/20 0.49
TLR4 O00206 1/20 0.47
TLR2 O60603 1/20 0.47
L3MBTL1 Q9Y468 1/20 0.47
HPGD P15428 1/20 0.47
RECQL P46063 2/20 0.47
NPC1 O15118 1/20 0.47
RAB9A P51151 1/20 0.47
HPSE Q9Y251 1/20 0.45
MAPT P10636 2/20 0.44
MAPK1 P28482 1/20 0.44
LTA4H P09960 1/20 0.44

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
SCHEMBL6136622 0.87 GPR35 (0.57) TDP1ALDH1A1TSHRGPR35L3MBTL1
SCHEMBL4363285 0.86 MEN1 (0.59) TDP1MEN1KMT2ATTRALB
SCHEMBL238962 0.85 L3MBTL1 (0.62) TDP1MEN1KMT2ATTRALB
SCHEMBL10845934 0.85 ALDH1A1 (0.48) TDP1MEN1KMT2AALDH1A1TSHR
SCHEMBL22588264 0.83 ALDH1A1 (0.53) TDP1MEN1KMT2ATTRALB
SCHEMBL11220314 0.83 TLR4 (0.47) TDP1MEN1KMT2ATTRALB
SCHEMBL10884667 0.83 RECQL (0.51) TDP1MEN1KMT2ATTRALB
SCHEMBL10822131 0.81 KMT2A (0.50) TDP1MEN1KMT2ATTRALB
SCHEMBL10482222 0.81 TLR8 (0.60) TDP1MEN1KMT2ATTRALB
SCHEMBL1997338 0.81 TLR4 (0.46) TDP1MEN1KMT2ATTRALB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116554041-A Method for preparing diaminodiphenyl ether by continuous catalytic hydrogenation based on trickle bed reactor 湖南贝泓科技开发有限公司 2023-08-08 CN claimed
CN-216078718-U Tail gas treatment equipment convenient for sealing and butt joint for production of dinitrodiphenyl ether 山东欧亚化工有限公司 2022-03-18 CN claimed
CN-215427809-U Tail gas treatment equipment convenient for pipeline positioning for production of dinitrodiphenyl ether 山东欧亚化工有限公司 2022-01-07 CN claimed
CN-215310733-U Dinitrodiphenyl ether filtration equipment 南通汇顺化工有限公司 2021-12-28 CN claimed
CN-215026076-U Purification device with good dinitrodiphenyl ether separation effect 南通汇顺化工有限公司 2021-12-07 CN claimed
CN-113663674-A Preparation method and application of porous microspheres and reduction method of nitro compound 珠海派锐尔新材料有限公司 2021-11-19 CN claimed
CN-214400310-U Nitration device for preparing dinitrodiphenyl ether 泰兴中科艾德膜材料科技有限公司 2021-10-15 CN claimed
CN-212741037-U Dinitrodiphenyl ether wastewater treatment device 南京简迪环境工程有限公司 2021-03-19 CN claimed
CN-111392949-A Dinitrodiphenyl ether wastewater treatment device and treatment process thereof 南京简迪环境工程有限公司 2020-07-10 CN claimed
EP-1015402-A1 METHOD FOR PRODUCING COMPOUNDS CONTAINING FLUORINE, IN PARTICULAR FLUOROBENZALDHYDES AND FLUOROBENZONITRILES Aventis Research & Technologies GmbH & Co. KG (DE) 2000-07-05 EP claimed
WO-1999011588-A1 METHOD FOR PRODUCING COMPOUNDS CONTAINING FLUORINE, IN PARTICULAR FLUOROBENZALDHYDES AND FLUOROBENZONITRILES AVENTIS RESEARCH & TECHNOLOGIES GMBH & CO. KG (DE) 1999-03-11 WO claimed
US-4558164-A Production of dinitrodiphenyl ether E. I. DU PONT DE NEMOURS AND COMPANY (US) 1985-12-10 US claimed
JP-1258651-A None JP disclosed
JP-1272558-A None JP disclosed
JP-10045690-A None JP disclosed
JP-61221157-A None JP disclosed
JP-S5732258-A PREPARATION OF HYDRAZINONITRODIPHENYL ETHER COMPOUND MITSUI TOATSU CHEM INC 1982-02-20 JP disclosed
US-4222962-A Process for preparing a substituted diphenoxybenzene GULF RESEARCH & DEVELOPMENT COMPANY (US) 1980-09-16 US disclosed
US-4005102-A METHYLENE CHLORIDE, NITRIC AND SULFURIC ACIDS GENERAL ELECTRIC COMPANY (US) 1977-01-25 US disclosed
US-3981933-A SULFURIC ACID, NITRIC ACID, TOLUENE IN METHYLENE CHLORIDE GENERAL ELECTRIC COMPANY (US) 1976-09-21 US disclosed