SCHEMBL28396264

SCHEMBL28396264

[N-]=[N+]=NC(=O)c1cccc(C(=O)N=[N+]=[N-])c1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.41
ATM Q13315 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
FURIN P09958 1/20 0.37
PBRM1 Q86U86 1/20 0.35
GABRA1 P14867 1/20 0.35
CA12 O43570 1/20 0.34
CA1 P00915 1/20 0.34
CA2 P00918 1/20 0.34
CA6 P23280 1/20 0.34
CA9 Q16790 1/20 0.34
CES2 O00748 1/20 0.34
CES1 P23141 1/20 0.34
HDAC8 Q9BY41 1/20 0.34
HDAC6 Q9UBN7 1/20 0.34
PARP1 P09874 1/20 0.33
MET P08581 1/20 0.33
PKM P14618 1/20 0.33
CYP1A2 P05177 1/20 0.33
CYP2C9 P11712 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
SCHEMBL28924563 0.88 PBRM1 (0.52) TDP1PBRM1CA12CA1CA2
SCHEMBL29200432 0.87 CES2 (0.55) L3MBTL1CES2CES1HDAC6PARP1
SCHEMBL19398201 0.87 PARP1 (0.52) TDP1HDAC8HDAC6PARP1KMT2A
SCHEMBL28151007 0.87 PARP1 (0.52) L3MBTL1PARP1PKMKMT2AMEN1
SCHEMBL29200417 0.87 PARP1 (0.52) L3MBTL1PARP1CYP1A2CYP2C19KMT2A
SCHEMBL18762041 0.86 GABRA1 (0.32) GABRA1
SCHEMBL30151360 0.85 KMO (0.55) TDP1HDAC8GAA
SCHEMBL17454634 0.85 KMO (0.55) TDP1HDAC8GAA
SCHEMBL13909938 0.85 IDO1 (0.33) L3MBTL1ATMTDP1GABRA1HDAC8
SCHEMBL13449660 0.84 CES1 (0.44) L3MBTL1ATMTDP1GABRA1CA12

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-109208100-B Spider silk-like polymer fiber based on polystyrene porous microspheres and preparation method thereof 中国石油化工股份有限公司 2022-07-12 CN claimed
CN-109208102-B Spider silk-like polymer fiber based on column chromatography silica gel and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-108624978-B Polymer fiber of bionic spider silk with water collection characteristic and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-109208101-B Spider silk-like polymer fiber based on spherical porous particles and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-109208109-B Spider silk-like polymer fiber and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-109208110-B Spider silk-like polymer fiber based on non-spherical porous particles and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-109208108-B Spider silk-like polymer fiber based on silica porous microspheres and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN claimed
CN-114797493-A Temperature-resistant composite separation membrane and preparation method thereof 西南石油大学 2022-07-29 CN disclosed
CN-109208100-B Spider silk-like polymer fiber based on polystyrene porous microspheres and preparation method thereof 中国石油化工股份有限公司 2022-07-12 CN disclosed
CN-109208102-B Spider silk-like polymer fiber based on column chromatography silica gel and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed
CN-108624978-B Polymer fiber of bionic spider silk with water collection characteristic and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed
CN-109208101-B Spider silk-like polymer fiber based on spherical porous particles and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed
CN-109208109-B Spider silk-like polymer fiber and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed
CN-109208108-B Spider silk-like polymer fiber based on silica porous microspheres and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed
CN-109208110-B Spider silk-like polymer fiber based on non-spherical porous particles and preparation method thereof 中国石油化工股份有限公司 2020-06-09 CN disclosed
CN-110997007-A Compounds comprising stapled or spliced peptides for improved drug delivery 苏图拉医疗有限公司 2020-04-10 CN disclosed