SCHEMBL9214229

SCHEMBL9214229

O=[N+]([O-])c1ccc(Oc2cccc([N+](=O)[O-])c2)cc1

nearest known ligand 0.73

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.73
KDM4E B2RXH2 1/20 0.67
HSPB1 P04792 1/20 0.59
LTA4H P09960 1/20 0.58
PTGS2 P35354 1/20 0.58
LMNA P02545 1/20 0.57
TSHR P16473 1/20 0.57
FFAR1 O14842 1/20 0.56
MEN1 O00255 3/20 0.54
KMT2A Q03164 3/20 0.54
PGR P06401 1/20 0.54
CRHBP P24387 1/20 0.53
CRHR2 Q13324 1/20 0.53
RAB9A P51151 2/20 0.52
CYP2C9 P11712 1/20 0.52
CYP2C19 P33261 1/20 0.52
LPAR3 Q9UBY5 1/20 0.52
MAPT P10636 2/20 0.51
NPC1 O15118 1/20 0.51
MAPK1 P28482 1/20 0.51

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
SCHEMBL9158141 0.96 ALDH1A1 (0.67) ALDH1A1KDM4EHSPB1LTA4HPTGS2
SCHEMBL9356592 0.96 ALDH1A1 (0.67) ALDH1A1KDM4EHSPB1LTA4HPTGS2
SCHEMBL7632953 0.92 ALDH1A1 (0.77) ALDH1A1KDM4EHSPB1LTA4HPTGS2
SCHEMBL27188054 0.92 ALDH1A1 (0.77) ALDH1A1KDM4EHSPB1LTA4HPTGS2
SCHEMBL4203388 0.92 TSHR (0.67) ALDH1A1KDM4ELTA4HPTGS2LMNA
SCHEMBL8775401 0.91 ALDH1A1 (0.61) ALDH1A1KDM4EHSPB1LTA4HPTGS2
SCHEMBL30042572 0.91 ALDH1A1 (0.61) ALDH1A1KDM4EHSPB1LTA4HPTGS2
SCHEMBL4456862 0.91 ALDH1A1 (0.60) ALDH1A1KDM4ELTA4HPTGS2LMNA
SCHEMBL6273333 0.90 TSHR (0.64) ALDH1A1KDM4ELTA4HPTGS2LMNA
SCHEMBL30043252 0.90 TSHR (0.64) ALDH1A1KDM4ELTA4HPTGS2LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118791390-A Preparation method of 3,4' -diaminodiphenyl ether 天津众泰材料科技有限公司 2024-10-18 CN claimed
CN-116554041-B 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 2024-07-26 CN claimed
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
JP-58157749-A None JP disclosed
JP-7118211-A None JP disclosed
JP-7206782-A None JP disclosed
JP-63044554-A None JP disclosed
JP-61221159-A None JP disclosed
CN-119528747-B Preparation method of 3,4' -diaminodiphenyl ether 烟台泰和新材高分子新材料研究院有限公司 2025-05-13 CN disclosed
CN-119528747-A Preparation method of 3,4' -diaminodiphenyl ether 烟台泰和新材高分子新材料研究院有限公司 2025-02-28 CN disclosed
CN-118791390-A Preparation method of 3,4' -diaminodiphenyl ether 天津众泰材料科技有限公司 2024-10-18 CN disclosed
CN-1269798-C Producing procedure of 3,4'-diamino diphenyl ether SHANGHAI SYNTHETIC RESIN INST (CN) 2006-08-16 CN disclosed
JP-H07206782-A PRODUCTION OF 3,4'-DINITRODIPHENYL ETHERS OR THEIR DERIVATIVES TEIJIN LTD 1995-08-08 JP disclosed
JP-H07118211-A PRODUCTION OF 3,4'-DINITRODIPHENYL ETHER TEIJIN LTD 1995-05-09 JP disclosed
US-5221798-A Changing the regiopurity of mixtures containing 4,4'-disubstituted diphenyl carbonates AMOCO CORPORATION (US) 1993-06-22 US disclosed
EP-0477853-A1 Process and novel intermediate for the preparation of 3,4'-diaminodiphenyl ether Bromine Compounds Ltd. (IL) 1992-04-01 EP disclosed
JP-S6344554-A PRODUCTION OF DIPHENYL ETHER COMPOUND HAVING AMINO GROUP AT M-POSITION AND P'-POSITION TEKUKEMU:KK 1988-02-25 JP disclosed
JP-S61221159-A PRODUCTION OF HIGH-PURITY 3,4'-DIAMINODIPHENYL ETHER MITSUI TOATSU CHEM INC 1986-10-01 JP disclosed
JP-S58157749-A PRODUCTION OF HIGH-PURITY 3,4'-DIAMINODIPHENYL ETHER MITSUI TOATSU CHEM INC 1983-09-19 JP disclosed
US-4042603-A SUBSTITUTED DIBENZOFURAN OR 9-FLUORENONE FROM A DIPHENYL ETHER OR BENZOPHENONE UBE INDUSTRIES, LTD. (JA) 1977-08-16 US disclosed