SCHEMBL526599

SCHEMBL526599

O=[N+]([O-])C1([N+](=O)[O-])C=CC=CC1c1ccccc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNA4 P22459 1/20 0.38
KCNA1 Q09470 1/20 0.38
KCNAB1 Q14722 1/20 0.38
MEN1 O00255 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
LMNA P02545 2/20 0.33
DNMT3B Q9UBC3 1/20 0.33
ALDH1A1 P00352 1/20 0.33

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
SCHEMBL9537044 0.78 MEN1 (0.35) KCNA4KCNA1KCNAB1MEN1CYP2C19
SCHEMBL16429623 0.78 MEN1 (0.35) KCNA4KCNA1KCNAB1MEN1CYP2C19
SCHEMBL9539166 0.75 MEN1 (0.35) KCNA4KCNA1KCNAB1MEN1CYP2C19
SCHEMBL7313249 0.72 FBP1 (0.36) MEN1CYP2C19KMT2ALMNAALDH1A1
SCHEMBL28381016 0.72 CPA1 (0.33) ALDH1A1
SCHEMBL734440 0.71 KDM1A (0.38)
SCHEMBL5149443 0.70 HTR2A (0.39)
SCHEMBL5458200 0.69
SCHEMBL365626 0.69 CHRNA7 (0.32)
SCHEMBL3728489 0.69

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 10 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4620916-A Degradation retardants for electrophoretic display devices EPID, INC. 1986-11-04 US claimed
CN-118125949-B Method for preparing azobenzene oxide compound from photocatalysis aromatic nitro compound 暨南大学 2024-07-02 CN disclosed
CN-118125949-A Method for preparing azobenzene oxide compound from photocatalysis aromatic nitro compound 暨南大学 2024-06-04 CN disclosed
CN-109232383-B Method for synthesizing 4-bromocarbazole 河南省科学院高新技术研究中心 2022-02-01 CN disclosed
CN-109232380-B Synthetic method of 4-bromocarbazole 新乡市润宇新材料科技有限公司 2021-08-10 CN disclosed
EP-2598474-B1 METHOD FOR CONTINUOUSLY PRODUCING NITROBENZENE BAYER IP GMBH (DE) 2014-06-18 EP disclosed
US-20130204043-A1 METHOD FOR CONTINUOUSLY PRODUCING NITROBENZENE Bayer Intellectual Property GmbH Creative Campus Monheim (DE) 2013-08-08 US disclosed
EP-2598474-A2 METHOD FOR CONTINUOUSLY PRODUCING NITROBENZENE Bayer Intellectual Property GmbH (DE) 2013-06-05 EP disclosed
US-20130095286-A1 OPTICAL RECORDING MEDIUM SONY CORPORATION (JP) 2013-04-18 US disclosed
WO-2012013678-A2 METHOD FOR CONTINUOUSLY PRODUCING NITROBENZENE BAYER MATERIALSCIENCE AG (DE) 2012-02-02 WO disclosed