SCHEMBL6849255

SCHEMBL6849255

C=Cc1ccccc1C=C.C=Cc1ccccc1CC

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.43
GABRA1 P14867 3/20 0.39
GABRB2 P47870 3/20 0.39
MGLL Q99685 1/20 0.36
CCR3 P51677 2/20 0.36
MEN1 O00255 1/20 0.35
LMNA P02545 1/20 0.35
THRB P10828 1/20 0.35
BLM P54132 1/20 0.35
KMT2A Q03164 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
MAPT P10636 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP24A1 Q07973 1/20 0.34
TSHR P16473 1/20 0.33
TP53 P04637 1/20 0.33
MAOA P21397 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
SCHEMBL8590907 0.98 ALDH1A1 (0.41) ALDH1A1GABRA1GABRB2MGLLCCR3
SCHEMBL14959 0.98 ALDH1A1 (0.44) ALDH1A1GABRA1GABRB2MGLLCCR3
SCHEMBL29749448 0.98 ALDH1A1 (0.44) ALDH1A1GABRA1GABRB2MGLLCCR3
Benzene SCHEMBL9141668 0.95 ALDH1A1 (0.43) ALDH1A1GABRA1GABRB2MGLLCCR3
Water SCHEMBL28085262 0.95 ALDH1A1 (0.43) ALDH1A1GABRA1GABRB2MGLLCCR3
SCHEMBL9576114 0.95 ALDH1A1 (0.43) ALDH1A1GABRA1GABRB2MGLLCCR3
SCHEMBL28802097 0.95 ALDH1A1 (0.43) ALDH1A1GABRA1GABRB2MGLLCCR3
Methylamine SCHEMBL1256495 0.93 ALDH1A1 (0.41) ALDH1A1GABRA1GABRB2MGLLCCR3
SCHEMBL27516529 0.93 ALDH1A1 (0.44) ALDH1A1GABRA1GABRB2MGLLMEN1
Dimethylamine SCHEMBL8062717 0.91 ALDH1A1 (0.40) ALDH1A1GABRA1GABRB2MGLLCCR3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116400002-A N, N-dimethylethanolamine detection method 山东绅联药业股份有限公司 2023-07-07 CN claimed
CN-115128188-A Detection method for nitrite in metronidazole and metronidazole tablets 天津力生制药股份有限公司 2022-09-30 CN claimed
CN-112834639-B Series connection method of solid phase extraction columns for separating volatile ester flavor substances in white spirit 宜宾五粮液股份有限公司 2022-06-21 CN claimed
CN-114324722-A Method for determining free sulfate of enoxaparin sodium by ion chromatography 辰欣药业股份有限公司 2022-04-12 CN claimed
CN-112834639-A Series connection method of solid phase extraction columns for separating volatile ester flavor substances in white spirit 宜宾五粮液股份有限公司 2021-05-25 CN claimed
CN-109507314-A The ion chromatography method of sodium, potassium, magnesium, calcium in Amino Acid Compound Injection 中科谱研(北京)科技有限公司 2019-03-22 CN claimed
CN-106512969-A Preparation and chemical modification method of polymer graphene composite chromatographic filling material 浙江大学 2017-03-22 CN claimed
CN-102621260-B Sophora fungus mycoplasma extract identification and detection method Qidong gaitianli pharmaceutical co ltd 2015-03-25 CN claimed
CN-103323541-A Quality detection method for heparin sodium tube-enveloping injection HU XIAOQUAN 2013-09-25 CN claimed
US-6780818-B2 ACCURATE DESORPTION; ELIMINATING ARTIFACTS; USING ACTIVATED CARBON AND MACRORETICULAR RESIN THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2004-08-24 US claimed
US-20240199515-A1 ULTRAVIOLET RAY IRRADIATION DEVICE, AND METHOD FOR PURIFYING ORGANIC COMPOUND TOKUYAMA CORPORATION (JP) 2024-06-20 US disclosed
EP-4328214-A1 ULTRAVIOLET RAY IRRADIATION DEVICE, AND METHOD FOR PURIFYING ORGANIC COMPOUND Tokuyama Corporation (JP) 2024-02-28 EP disclosed
CN-116785248-A Low-molecular heparin sodium freeze-dried powder and preparation process thereof 河南省人民医院 2023-09-22 CN disclosed
CN-116400002-A N, N-dimethylethanolamine detection method 山东绅联药业股份有限公司 2023-07-07 CN disclosed
EP-4100456-A1 NEW TACKIFIER FOR ELASTOMER COMPOUNDS Rain Carbon Germany GmbH (DE) 2022-12-14 EP disclosed
US-4454879-A POLYMERIC ADSORBANT AND A GAS ROHM AND HAAS COMPANY (US) 1984-06-19 US disclosed
EP-0033262-A1 Electrolysis diaphragm and method for its manufacture ELF ATOCHEM S.A. (FR) 1981-08-05 EP disclosed
US-4182849-A DETERGENTS, ALGICIDES, BACTERICIDES THE DOW CHEMICAL COMPANY (US) 1980-01-08 US disclosed
US-4015599-A Anesthetic delivery system ROHM AND HAAS COMPANY (US) 1977-04-05 US disclosed
US-3945811-A CROSSLINKED MACRORETICULAR RESIN ROHM AND HAAS COMPANY (US) 1976-03-23 US disclosed