SCHEMBL28050604

SCHEMBL28050604

Cc1cc(C(=O)O)c(N)c(C(=O)O)c1C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.57
KMT2A Q03164 4/20 0.47
GABRP O00591 2/20 0.44
GABRD O14764 2/20 0.44
GABRA1 P14867 2/20 0.44
GABRB1 P18505 2/20 0.44
GABRG2 P18507 2/20 0.44
GABRB3 P28472 2/20 0.44
GABRA5 P31644 2/20 0.44
GABRA3 P34903 2/20 0.44
GABRA2 P47869 2/20 0.44
GABRB2 P47870 2/20 0.44
GABRA4 P48169 2/20 0.44
GABRE P78334 2/20 0.44
GABRA6 Q16445 2/20 0.44
GABRG1 Q8N1C3 2/20 0.44
GABRG3 Q99928 2/20 0.44
GABRQ Q9UN88 2/20 0.44
CYP3A4 P08684 2/20 0.44
ACHE P22303 1/20 0.44

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
SCHEMBL9259491 0.86 KDM4E (0.55) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL31494237 0.86 KDM4E (0.55) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL2825688 0.86 KDM4E (0.55) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL27755203 0.84 AKR1C3 (0.50) KDM4EKMT2ACYP3A4ALDH1A1GAA
SCHEMBL2529829 0.80 CYP3A4 (0.48) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL1709593 0.80 KDM4E (0.50) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL5530847 0.78 KDM4E (0.55) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL9305599 0.78 KDM4E (0.55) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL5489960 0.78 KDM4E (0.50) KDM4EKMT2AGABRPGABRDGABRA1
SCHEMBL28198037 0.78 KDM4E (0.55) KDM4EKMT2AGABRPGABRDGABRA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-107549871-A It is a kind of to eliminate composition of harmful substance and application thereof in cigarette or air 重庆市江北区健希环保新材料科技有限公司 2018-01-09 CN claimed
CN-107185313-A Material and device for eliminating air pollutants in motor vehicle interior 昆山瑞程新美新材料有限公司 2017-09-22 CN claimed
CN-106459590-B Porous membranes comprising metal-organic framework materials 巴斯夫欧洲公司 2019-11-05 CN disclosed
CN-105579128-B The method that recycling forms the component of metal-organic framework materials 巴斯夫欧洲公司 2019-10-08 CN disclosed
CN-106922168-B The storage container of integral type formed body including porosu solid 巴斯夫欧洲公司 2019-09-03 CN disclosed
CN-107074429-B Sorbent materials for extended produce (product) shelf life 巴斯夫公司 2019-08-09 CN disclosed
CN-108290134-A The ultrafast high space time yield synthesis of metal-organic framework 巴斯夫欧洲公司 2018-07-17 CN disclosed
CN-108290136-A Method for producing molding compositions and for producing molded bodies 巴斯夫欧洲公司 2018-07-17 CN disclosed
CN-107549871-A It is a kind of to eliminate composition of harmful substance and application thereof in cigarette or air 重庆市江北区健希环保新材料科技有限公司 2018-01-09 CN disclosed
CN-107185313-A Material and device for eliminating air pollutants in motor vehicle interior 昆山瑞程新美新材料有限公司 2017-09-22 CN disclosed
CN-107074429-A Sorbent materials for extended produce (product) shelf life 巴斯夫公司 2017-08-18 CN disclosed
CN-106922168-A The storage container of the integral type formed body including porosu solid 巴斯夫欧洲公司 2017-07-04 CN disclosed
CN-106459590-A Porous membranes comprising metal-organic framework materials 巴斯夫欧洲公司 2017-02-22 CN disclosed
CN-105418506-A Acetobenzylamide piperazine derivative and application thereof as cranial nerve protective agent SHANGHAI INST PHARMACEUTICAL IND 2016-03-23 CN disclosed