SCHEMBL8977879

SCHEMBL8977879

O=[N+]([O-])C(CCc1ccccc1)[N+](=O)[O-]

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 3/20 0.43
ERAP1 Q9NZ08 3/20 0.43
ERAP2 Q6P179 2/20 0.43
CYP1A2 P05177 1/20 0.42
CYP2C19 P33261 1/20 0.42
ACP3 P15309 1/20 0.42
ALDH1A1 P00352 1/20 0.41
NPC1 O15118 1/20 0.41
RAB9A P51151 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
TAAR1 Q96RJ0 1/20 0.41
CPA1 P15085 3/20 0.41
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
CNR2 P34972 1/20 0.41
TSHR P16473 1/20 0.41
SIGMAR1 Q99720 1/20 0.41
PKM P14618 1/20 0.40

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
SCHEMBL19326616 0.88 SIGMAR1 (0.45) CYP1A2ALDH1A1NPC1RAB9ASMN1; SMN2
SCHEMBL10980609 0.85 TRPA1 (0.46) SIGMAR1
SCHEMBL1286811 0.80 ANPEP (0.41) ANPEPERAP1ERAP2CYP1A2CYP2C19
SCHEMBL19025403 0.80 ANPEP (0.44) ANPEPERAP1ERAP2CYP1A2CYP2C19
SCHEMBL187342 0.78 CPA1 (0.52) CYP1A2ALDH1A1TAAR1CPA1SIGMAR1
SCHEMBL9356160 0.77 ANPEP (0.42) ANPEPERAP1ERAP2CYP1A2CYP2C19
SCHEMBL7517589 0.77 ANPEP (0.42) ANPEPERAP1ERAP2ACP3ALDH1A1
SCHEMBL475203 0.77 CPA1 (0.47) ANPEPERAP1ERAP2CPA1CNR2
SCHEMBL5609700 0.76 FDFT1 (0.47) NPC1RAB9ASMN1; SMN2SIGMAR1
SCHEMBL1149281 0.74 TSHR (0.45) ANPEPERAP1ERAP2CYP1A2CYP2C19

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10995289-B2 Gasoline product containing combustion improver and manufacturing method therefor ZHOU (BEIJING) AUTOMOTIVE TECHNOLOGY CO., LTD. (CN) 2021-05-04 US claimed
US-20170335212-A1 GASOLINE PRODUCT CONTAINING COMBUSTION IMPROVER AND MANUFACTURING METHOD THEREFOR ZHOU (BEIJING) AUTOMOTIVE TECHNOLOGY CO., LTD. (CN) 2017-11-23 US claimed
EP-3216845-A1 GASOLINE PRODUCT CONTAINING COMBUSTION IMPROVER AND MANUFACTURING METHOD THEREFOR Zhou, Xiangjin (CN) 2017-09-13 EP claimed
CN-107109265-A Gasoline product containing combustion improver and its production method 周向进 2017-08-29 CN claimed
US-10995289-B2 Gasoline product containing combustion improver and manufacturing method therefor ZHOU (BEIJING) AUTOMOTIVE TECHNOLOGY CO., LTD. (CN) 2021-05-04 US disclosed
US-20170335212-A1 GASOLINE PRODUCT CONTAINING COMBUSTION IMPROVER AND MANUFACTURING METHOD THEREFOR ZHOU (BEIJING) AUTOMOTIVE TECHNOLOGY CO., LTD. (CN) 2017-11-23 US disclosed
EP-3216845-A1 GASOLINE PRODUCT CONTAINING COMBUSTION IMPROVER AND MANUFACTURING METHOD THEREFOR Zhou, Xiangjin (CN) 2017-09-13 EP disclosed
CN-107109265-A Gasoline product containing combustion improver and its production method 周向进 2017-08-29 CN disclosed
US-5500060-A IMPROVED SAFETY RELATED TO UNWANTED IGNITION, NITRAMINE COMPOUNDS, AROMATIC NITRO COMPOUNDS ROYAL ORDNANCE PLC (GB) 1996-03-19 US disclosed
EP-0410684-B1 Method of condensing N-phenylcarbamates ENICHEM SINTESI (IT) 1994-11-30 EP disclosed
US-5079383-A With A Methylating Agent Using A Zinc Halide Catalyst MITSUI PETROCHEMICAL INDUSTRIES, LTD. (JP) 1992-01-07 US disclosed
EP-0410684-A2 Method of condensing N-phenylcarbamates ENICHEM SYNTHESIS S.p.A. (IT) 1991-01-30 EP disclosed