SCHEMBL17907467

SCHEMBL17907467

Cc1cccc(C)c1-c1cc(C(N)=O)ccc1C(N)=O

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
PARP1 P09874 7/20 0.50
MYC P01106 1/20 0.46
PARP15 Q460N3 2/20 0.41
PARP10 Q53GL7 2/20 0.41
MKNK1 Q9BUB5 1/20 0.41
MKNK2 Q9HBH9 1/20 0.41
TNKS O95271 1/20 0.40
PARP14 Q460N5 1/20 0.40
TNKS2 Q9H2K2 1/20 0.40
PARP2 Q9UGN5 1/20 0.40
AR P10275 2/20 0.40
CA1 P00915 1/20 0.39
CA2 P00918 1/20 0.39
CA7 P43166 1/20 0.39
CA9 Q16790 1/20 0.39
TYMS P04818 1/20 0.38
HTR7 P34969 1/20 0.38
HTR2B P41595 1/20 0.38

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
SCHEMBL4211451 0.86 PARP1 (0.50) PARP1MYCPARP15PARP10MKNK1
SCHEMBL8103063 0.79 MYC (0.64) MYCTYMS
SCHEMBL2128609 0.79 PARP1 (0.52) PARP1PARP10MKNK1MKNK2PARP2
SCHEMBL4138458 0.78 MYC (0.72) PARP1MYCCA1CA2CA7
SCHEMBL27597015 0.78 KEAP1 (0.47) PARP1PARP15PARP10TNKSPARP14
Water SCHEMBL27919080 0.77 KEAP1 (0.46) PARP1PARP15PARP10TNKSPARP14
SCHEMBL17907470 0.77 S1PR4 (0.49) PARP1
SCHEMBL28244862 0.76 SLC22A12 (0.39) PARP1PARP10MKNK1MKNK2
Dimethylamine SCHEMBL9236857 0.75 PARP1 (0.54) PARP1
SCHEMBL3265708 0.75 BCAT2 (0.63) PARP1MKNK1MKNK2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115353667-A Method and material for reducing waste 李蓁蓁 2022-11-18 CN disclosed
US-11254082-B2 Multi-layer tube UBE INDUSTRIES, LTD. (JP) 2022-02-22 US disclosed
US-10663092-B2 Multilayer tube UBE INDUSTRIES, LTD. (JP) 2020-05-26 US disclosed
EP-3042758-B1 LAMINATED TUBE UBE INDUSTRIES (JP) 2020-05-06 EP disclosed
EP-3461631-A1 MULTILAYER TUBE Ube Industries, Ltd. (JP) 2019-04-03 EP disclosed
EP-3192650-B1 LAYERED TUBE UBE INDUSTRIES (JP) 2019-01-23 EP disclosed
US-20170261133-A1 MULTILAYER TUBE UBE INDUSTRIES, LTD. (JP) 2017-09-14 US disclosed
EP-3192650-A1 LAYERED TUBE UBE Industries, Ltd. (JP) 2017-07-19 EP disclosed
US-20160214343-A1 MULTI-LAYER TUBE UBE INDUSTRIES, LTD. (JP) 2016-07-28 US disclosed
EP-3042758-A1 LAMINATED TUBE UBE Industries, Ltd. (JP) 2016-07-13 EP disclosed