SCHEMBL28128591

SCHEMBL28128591

CCC(CCCC(=O)O)C(N)N1C(=O)C=CC1=O

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGS1 P23219 4/20 0.41
PTGS2 P35354 4/20 0.41
ENPEP Q07075 3/20 0.40
ALDH1A1 P00352 1/20 0.37
CYSLTR2 Q9NS75 1/20 0.35
CYSLTR1 Q9Y271 1/20 0.35
GABRP O00591 2/20 0.33
GABRD O14764 2/20 0.33
GABRA1 P14867 2/20 0.33
GABRB1 P18505 2/20 0.33
GABRG2 P18507 2/20 0.33
GABRB3 P28472 2/20 0.33
GABRA5 P31644 2/20 0.33
GABRA3 P34903 2/20 0.33
GABRA2 P47869 2/20 0.33
GABRB2 P47870 2/20 0.33
GABRA4 P48169 2/20 0.33
GABRE P78334 2/20 0.33
GABRA6 Q16445 2/20 0.33
GABRG1 Q8N1C3 2/20 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
SCHEMBL28258643 0.78 PTGS1 (0.45) PTGS1PTGS2ENPEPALDH1A1CYSLTR2
SCHEMBL326701 0.74 PTGS1 (0.47) PTGS1PTGS2ENPEPALDH1A1GABRP
SCHEMBL5873778 0.74 PTGS1 (0.47) PTGS1PTGS2ENPEPALDH1A1GSTK1
SCHEMBL14360113 0.73 ALDH1A1 (0.50) ALDH1A1FFAR4
SCHEMBL28406949 0.73 PTGS1 (0.50) PTGS1PTGS2ALDH1A1GSTK1FFAR4
SCHEMBL2494888 0.71 PTGS1 (0.40) PTGS1PTGS2ENPEPALDH1A1GABRP
SCHEMBL29505890 0.71 KDM4E (0.49) PTGS1PTGS2ENPEPALDH1A1GSTK1
SCHEMBL27690608 0.71 ENPEP (0.44) PTGS1PTGS2ENPEPALDH1A1GABRP
SCHEMBL28536934 0.70 PTGS1 (0.50) PTGS1PTGS2ENPEPALDH1A1GSTK1
SCHEMBL7053269 0.70 FFAR4 (0.47) PTGS1PTGS2ALDH1A1FFAR4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-103384681-B Binding agents 霍夫曼-拉罗奇有限公司 2018-05-18 CN disclosed
CN-107586340-A To T cell activation antigen and the bispecific antibody and application method of specific for tumour antigen 罗切格利卡特公司 2018-01-16 CN disclosed
CN-107531788-A To HER2 and the three-specific antibody and application method of blood-brain barrier receptor-specific 豪夫迈·罗氏有限公司 2018-01-02 CN disclosed
CN-103889452-B Bispecific antibodies specific for T cell activating antigens and tumor antigens and methods of use 罗切格利卡特公司 2017-11-03 CN disclosed
CN-103384825-B Detection of post-translationally modified polypeptides by bivalent binding agents 霍夫曼-拉罗奇有限公司 2017-05-24 CN disclosed
CN-106432496-A Anti-CD79B antibodies and immunoconjugates and methods of use 健泰科生物技术公司 2017-02-22 CN disclosed