Nitrobenzene

Nitrobenzene

SCHEMBL28448771

N=[N+]=N.O=[N+]([O-])c1ccccc1

nearest known ligand 0.80

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ALDH1A1 P00352 4/20 0.80
▸ LMNA P02545 2/20 0.80
▸ TSHR P16473 2/20 0.54
▸ L3MBTL1 Q9Y468 2/20 0.54
▸ MEN1 O00255 1/20 0.54
▸ CRHBP P24387 1/20 0.54
▸ KMT2A Q03164 1/20 0.54
▸ ATM Q13315 1/20 0.54
▸ CRHR2 Q13324 1/20 0.54
▸ TLR9 Q9NR96 1/20 0.54
▸ HPGD P15428 1/20 0.54
▸ ALOX12 P18054 1/20 0.54
▸ CES2 O00748 1/20 0.52
▸ CES1 P23141 1/20 0.52
▸ NFE2L2 Q16236 1/20 0.48
▸ POLB P06746 1/20 0.47
▸ MAPK1 P28482 1/20 0.47
▸ CYP1A2 P05177 1/20 0.47
▸ CYP2C19 P33261 1/20 0.47
▸ TDP1 Q9NUW8 1/20 0.46

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
Nitrobenzene SCHEMBL16968450 0.91 ALDH1A1 (0.73) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL1330825 0.89 — —
Nitrobenzene SCHEMBL2255264 0.89 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL15525745 0.89 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL20411 0.89 — —
Nitrobenzene SCHEMBL9669095 0.89 — —
Nitrobenzene SCHEMBL2358164 0.89 ALDH1A1 (1.00) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL1330714 0.89 — —
Nitrobenzene SCHEMBL25293390 0.87 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1MEN1
Nitrobenzene SCHEMBL3888859 0.87 ALDH1A1 (0.94) ALDH1A1LMNATSHRL3MBTL1MEN1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116148366-B Protein complex in-situ analysis method based on active oxygen response carrier 中国科学院大连化学物理研究所 2024-12-10 — — CN claimed
CN-116148366-A Protein complex in-situ analysis method based on active oxygen response carrier 中国科学院大连化学物理研究所 2023-05-23 — — CN claimed
CN-112083082-B Carrier for in-situ analysis of intracellular protein complex and preparation method and application thereof 中国科学院大连化学物理研究所 2022-03-29 — — CN claimed
CN-112083081-B In-situ analysis method for intracellular protein complex and application thereof 中国科学院大连化学物理研究所 2022-02-08 — — CN claimed
CN-112485339-A Phase separation-based cross-linking agent carrier and preparation and application thereof 中国科学院大连化学物理研究所 2021-03-12 — — CN claimed
CN-112083081-A In-situ analysis method for intracellular protein complex and application thereof 中国科学院大连化学物理研究所 2020-12-15 — — CN claimed
CN-112083082-A Carrier for in-situ analysis of intracellular protein complex and preparation method and application thereof 中国科学院大连化学物理研究所 2020-12-15 — — CN claimed
CN-107525842-B Analytical method for studying protein structure or protein interaction 中国科学院大连化学物理研究所 2020-08-11 — — CN claimed
CN-112083082-B Carrier for in-situ analysis of intracellular protein complex and preparation method and application thereof 中国科学院大连化学物理研究所 2022-03-29 — — CN disclosed
CN-112083081-B In-situ analysis method for intracellular protein complex and application thereof 中国科学院大连化学物理研究所 2022-02-08 — — CN disclosed
CN-112485339-A Phase separation-based cross-linking agent carrier and preparation and application thereof 中国科学院大连化学物理研究所 2021-03-12 — — CN disclosed
CN-112105380-A NETIN-1 BINDING ANTIBODIES AND USES THEREOF 埃缇健康公司D/B/A泽尔拜尔 2020-12-18 — — CN disclosed
CN-112083082-A Carrier for in-situ analysis of intracellular protein complex and preparation method and application thereof 中国科学院大连化学物理研究所 2020-12-15 — — CN disclosed
CN-112083081-A In-situ analysis method for intracellular protein complex and application thereof 中国科学院大连化学物理研究所 2020-12-15 — — CN disclosed
CN-107525842-B Analytical method for studying protein structure or protein interaction 中国科学院大连化学物理研究所 2020-08-11 — — CN disclosed
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