SCHEMBL1288174

SCHEMBL1288174

CN(N)c1ccc([N+](=O)[O-])cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 3/20 0.56
▸ MAPK1 P28482 3/20 0.56
▸ L3MBTL1 Q9Y468 2/20 0.56
▸ TSHR P16473 2/20 0.56
▸ CYP1A2 P05177 1/20 0.56
▸ CYP3A4 P08684 1/20 0.56
▸ PHLPP2 Q6ZVD8 1/20 0.56
▸ TDP1 Q9NUW8 1/20 0.56
▸ ALDH1A1 P00352 3/20 0.53
▸ CRHBP P24387 2/20 0.53
▸ CRHR2 Q13324 2/20 0.53
▸ MEN1 O00255 2/20 0.53
▸ KMT2A Q03164 2/20 0.53
▸ ATM Q13315 1/20 0.53
▸ TLR9 Q9NR96 1/20 0.53
▸ HSD17B10 Q99714 2/20 0.52
▸ ACHE P22303 1/20 0.52
▸ CA12 O43570 3/20 0.50
▸ CA1 P00915 3/20 0.50
▸ CA2 P00918 3/20 0.50

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
SCHEMBL21474173 0.82 MAPT (0.60) MAPTMAPK1L3MBTL1TSHRCYP1A2
SCHEMBL14165160 0.82 MAPT (0.60) MAPTMAPK1L3MBTL1TSHRCYP1A2
SCHEMBL218018 0.82 MAPT (0.78) MAPTMAPK1L3MBTL1TSHRCYP1A2
SCHEMBL7918843 0.82 ALDH1A1 (0.57) MAPTMAPK1L3MBTL1TSHRCYP1A2
SCHEMBL27434423 0.82 ALDH1A1 (0.57) MAPTMAPK1L3MBTL1TSHRCYP1A2
Phosphine SCHEMBL30201038 0.80 MAPT (0.75) MAPTMAPK1L3MBTL1TSHRCYP1A2
Hydrogen Sulfide SCHEMBL28326954 0.80 MAPT (0.75) MAPTMAPK1L3MBTL1TSHRCYP1A2
Ammonia Solution, Strong SCHEMBL29558993 0.80 MAPT (0.75) MAPTMAPK1L3MBTL1TSHRCYP1A2
SCHEMBL3310982 0.78 MAPT (0.56) MAPTMAPK1L3MBTL1TSHRCYP1A2
Iodide SCHEMBL10484653 0.78 MAPT (0.72) MAPTMAPK1L3MBTL1TSHRCYP1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1807223-A Dynamic molecule base electron device based on hydrazine derived biological molecular material UNIV FUDAN (CN) 2006-07-26 — — CN claimed
US-11912877-B2 Aluminum-based coupling agents BRANT PATRICK (US) 2024-02-27 — — US disclosed
WO-2023141150-A1 ALUMINUM-BASED COUPLING AGENTS DITTHAVONG, STEINER, & MLOTKOWSKI (US) 2023-07-27 — — WO disclosed
US-20230227659-A1 ALUMINUM-BASED COUPLING AGENTS BRANT PATRICK (US) 2023-07-20 — — US disclosed
US-10017708-B2 Lubricant and fuel dispersants and methods of preparation thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2018-07-10 — — US disclosed
US-20170022443-A1 EMULSIFIER COMPONENTS AND METHODS OF USING THE SAME LUBRIZOL CORP (US) 2017-01-26 — — US disclosed
EP-3114195-A2 EMULSIFIER COMPONENTS AND METHODS OF USING THE SAME The Lubrizol Corporation (US) 2017-01-11 — — EP disclosed
US-9315761-B2 Lubricant and fuel dispersants and methods of preparation thereof EXXONMOBIL CHEMICAL PATENTS INC. (US) 2016-04-19 — — US disclosed
WO-2015134129-A2 EMULSIFIER COMPONENTS AND METHODS OF USING THE SAME THE LUBRIZOL CORPORATION (US) 2015-09-11 — — WO disclosed
CN-103079689-B Salt composition and explosive using the same LUBRIZOL CORP 2015-04-08 — — CN disclosed
US-4129510-A Sulfur-containing compounds and lubricants and fuels containing them THE LUBRIZOL CORPORATION (US) 1978-12-12 — — US disclosed
US-4128488-A Overbased phenoxide-halo carboxylic acid condensate additives for lubricants THE LUBRIZOL CORPORATION (US) 1978-12-05 — — US disclosed
US-4108784-A Hydroxyalkyl hydroxy-aromatic condensation products as fuel and lubricant additives THE LUBRIZOL CORPORATION (US) 1978-08-22 — — US disclosed
US-4108783-A Haloalkyl hydroxy-aromatic condensation products as fuel and lubricant additives THE LUBRIZOL CORPORATION (US) 1978-08-22 — — US disclosed
US-4090971-A Substituted salicylamides and lubricants containing the same THE LUBRIZOL CORPORATION (US) 1978-05-23 — — US disclosed
US-4067698-A Bridged phenol metal salt-halo carboxylic acid condensate additives for fuels THE LUBRIZOL CORPORATION (US) 1978-01-10 — — US disclosed
US-4061474-A Phenoxide-halo carboxylic acid condensate additives for fuels THE LUBRIZOL CORPORATION (US) 1977-12-06 — — US disclosed
US-4016150-A Sulfur and nitrogen-containing organic compositions processes for making them and fuels and additives containing them THE LUBRIZOL CORPORATION (US) 1977-04-05 — — US disclosed
US-4002686-A Method of preparing primary aliphatic mercaptans THE LUBRIZOL CORPORATION (US) 1977-01-11 — — US disclosed
US-3981869-A BENZOTHIAZOLE, BENZOXAZOLE AND INDOLE DYES BAYER AKTIENGESELLSCHAFT (DT) 1976-09-21 — — US disclosed
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