SCHEMBL1425850

SCHEMBL1425850

O=NOCc1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.52
ALDH1A1 P00352 4/20 0.50
IDO1 P14902 1/20 0.48
AGXT P21549 1/20 0.46
CA1 P00915 1/20 0.45
CA2 P00918 1/20 0.45
CA9 Q16790 1/20 0.45
KMT2A Q03164 2/20 0.43
SLC6A2 P23975 2/20 0.43
SLC6A3 Q01959 2/20 0.43
MAPK1 P28482 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
MAOA P21397 1/20 0.42
MAOB P27338 1/20 0.42
EPHX2 P34913 1/20 0.42
NPC1 O15118 3/20 0.42
RAB9A P51151 3/20 0.42
MEN1 O00255 1/20 0.42
LMNA P02545 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
Hydrochloric Acid SCHEMBL7794099 0.98 TSHR (0.50) TSHRALDH1A1IDO1AGXTCA1
Ammonia Solution, Strong SCHEMBL5804107 0.98 TSHR (0.50) TSHRALDH1A1IDO1AGXTCA1
Cyclohexane SCHEMBL28522422 0.93 TSHR (0.46) TSHRALDH1A1IDO1AGXTCA1
Hydroxyamine SCHEMBL28178637 0.93 ALDH1A1 (0.50) TSHRALDH1A1IDO1AGXTCA1
SCHEMBL24133222 0.87 IDO1 (0.55) TSHRIDO1AGXTKMT2ANPC1
SCHEMBL16005783 0.79 TSHR (0.57) TSHRALDH1A1IDO1AGXTCA1
SCHEMBL7566657 0.78 IDO1 (0.50) ALDH1A1IDO1CA2KMT2ASLC6A2
SCHEMBL3255086 0.77 TSHR (0.55) TSHRALDH1A1IDO1AGXTCA1
SCHEMBL21447792 0.76 CYP3A4 (0.44) TSHRALDH1A1CA2CA9KMT2A
SCHEMBL3819917 0.76 CA1 (0.48) TSHRALDH1A1IDO1CA1CA2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-118451072-A Biphenyl tetrazole compound and preparation method thereof 浙江华海药业股份有限公司 2024-08-06 CN claimed
WO-2023109731-A1 BIPHENYLTETRAZOLE COMPOUND AND PREPARATION METHOD THEREFOR 浙江华海药业股份有限公司 2023-06-22 WO claimed
US-20220216519-A1 Lithium ion batteries WACKER CHEMIE AG (DE) 2022-07-07 US claimed
EP-3956935-A1 LITHIUM ION BATTERIES Wacker Chemie AG (DE) 2022-02-23 EP claimed
CN-112823438-A Lithium ion battery 瓦克化学股份公司 2021-05-18 CN claimed
CN-112778203-A Process for the preparation of 1H-indazole-3-carboxylic acid derivatives and granisetron and lonidamine 兰州交通大学 2021-05-11 CN claimed
CN-111943878-A Benzo beta-lactam and preparation method thereof 兰州交通大学 2020-11-17 CN claimed
CN-107011133-B Method for directly oxidizing benzylic C-H bond into ketone 中国科学技术大学 2020-01-03 CN claimed
CN-109232447-A The preparation method of 1H-1,2,3- triazole 上海晋景化学有限公司 2019-01-18 CN claimed
CN-108314599-A A kind of method that aldehyde or alcohol are directly translated into carboxylic acid 中国科学技术大学 2018-07-24 CN claimed
US-20020094480-A1 Electrochemical cell having an electrode with a nitrite additive in the electrode active mixture GREATBATCH LTD. 2002-07-18 US claimed
US-6210839-B1 ALKYL NITRITE COMPOUND AS COSOLVENT IN THE ELECTROLYTE SOLUTION, WILSON GREATBATCH LTD. 2001-04-03 US claimed
EP-1005098-A2 Alkali metal electrochemical cell having an improved cathode activated with a nonaqueous electrolyte having a passivation inhibitor additive WILSON GREATBATCH LTD. (US) 2000-05-31 EP claimed
US-6027827-A ALKALI METAL, SOLID CATHODE, NONAQUEOUS ELECTROCHEMICAL CELL CAPABLE OF DELIVERING HIGH CURRENT PULSES, RAPIDLY RECOVERING ITS OPEN CIRCUIT VOLTAGE AND HAVING HIGH CURRENT CAPACITY WILSON GREATBATCH LTD. (US) 2000-02-22 US claimed
EP-0425197-B2 Process for preparing diester of carbonic acid UBE INDUSTRIES (JP) 1998-07-29 EP claimed
EP-0501507-B1 Process for preparing diester of carbonic acid UBE INDUSTRIES (JP) 1995-09-27 EP claimed
US-5162563-A From Carbon Monoxide and Organic Nitrite, Platinum Group Catalyst UBE INDUSTRIES, LTD. (JP) 1992-11-10 US claimed
EP-0501507-A2 Process for preparing diester of carbonic acid UBE INDUSTRIES, LTD. (JP) 1992-09-02 EP claimed
EP-0425197-A2 Process for preparing diester of carbonic acid UBE INDUSTRIES, LTD. (JP) 1991-05-02 EP claimed
EP-0151195-A1 Nitrite gel suppressants PHILLIPS PETROLEUM COMPANY (US) 1985-08-14 EP claimed