SCHEMBL2048833

SCHEMBL2048833

CCCCCn1c(=O)[nH]c(=O)[nH]c1=O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.47
ATM Q13315 1/20 0.47
HTT P42858 2/20 0.46
MAPK10 P53779 1/20 0.46
TSHR P16473 2/20 0.44
TP53 P04637 1/20 0.44
XBP1 P17861 1/20 0.44
RAB9A P51151 1/20 0.44
KDM4E B2RXH2 4/20 0.44
GAA P10253 3/20 0.44
ALDH1A1 P00352 3/20 0.44
HPGD P15428 2/20 0.43
LMNA P02545 2/20 0.43
HSD17B10 Q99714 1/20 0.43
MAPK1 P28482 1/20 0.43
PDE4A P27815 2/20 0.42
ADORA2A P29274 2/20 0.42
PDE4B Q07343 2/20 0.42
PDE4C Q08493 2/20 0.42
PDE4D Q08499 2/20 0.42

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
SCHEMBL11359991 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL11364443 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL29464059 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL678855 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL11357728 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL4954143 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL7749303 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL4105918 0.98 HTT (0.49) MAPTATMHTTMAPK10TSHR
SCHEMBL2784423 0.93 ATM (0.53) MAPTATMHTTTSHRTP53
SCHEMBL11709001 0.91 ATM (0.51) MAPTATMHTTTSHRTP53

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115286588-B Process for the preparation of pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2024-07-09 CN claimed
US-20240150512-A1 Resin Composition Including Curable Polymer Compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US claimed
CN-115286588-A Process for preparing pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2022-11-04 CN claimed
WO-1993006157-A1 CYANURATE BASED FIRE RETARDANT CONCENTRATES FR POLYMERS, INC. (US) 1993-04-01 WO claimed
US-5135974-A Reacting an amino-s-triazine and a base-solubilized cyanurate in a fluid thermoplastic resin; comminuting the fine and uniformly-distributed precipitated particles in the polymer matrix FR POLYMERS, INC. (US) 1992-08-04 US claimed
EP-0248288-A2 Trisubstituted 1,3,5-triazine-2,4,6-triones BAYER AG (DE) 1987-12-09 EP claimed
CN-115286588-B Process for the preparation of pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2024-07-09 CN disclosed
CN-115286588-B Process for the preparation of pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2024-07-09 CN disclosed
CN-115286588-B Process for the preparation of pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2024-07-09 CN disclosed
US-20240150512-A1 Resin Composition Including Curable Polymer Compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US disclosed
US-20240150512-A1 Resin Composition Including Curable Polymer Compound NIPPON KAYAKU KABUSHIKI KAISHA (JP) 2024-05-09 US disclosed
CN-115286588-A Process for preparing pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2022-11-04 CN disclosed
CN-115286588-A Process for preparing pentamethylene isocyanurate 中海油常州涂料化工研究院有限公司 2022-11-04 CN disclosed
WO-2000050409-A1 1-ARYL-1,3,5-TRIAZINE-4-THIONE-2,6-DIONES, PRODUCTION THEREOF AND USE THEREOF AS HERBICIDES BASF AKTIENGESELLSCHAFT (DE) 2000-08-31 WO disclosed
WO-1993006157-A1 CYANURATE BASED FIRE RETARDANT CONCENTRATES FR POLYMERS, INC. (US) 1993-04-01 WO disclosed
US-5135974-A Reacting an amino-s-triazine and a base-solubilized cyanurate in a fluid thermoplastic resin; comminuting the fine and uniformly-distributed precipitated particles in the polymer matrix FR POLYMERS, INC. (US) 1992-08-04 US disclosed
EP-0364765-A2 Substituted 1,3,5-triazinetriones, process for their preparation, and their use against parasitical protozoa BAYER AG (DE) 1990-04-25 EP disclosed
US-4863831-A Photosensitive lithographic plate requiring no dampening water having a gelatin primer layer FUJI PHOTO FILM CO., LTD. (JP) 1989-09-05 US disclosed
EP-0248288-A3 TRISUBSTITUTED 1,3,5-TRIAZINE-2,4,6-TRIONES BAYER AG (DE) 1988-08-17 EP disclosed
EP-0248288-A2 Trisubstituted 1,3,5-triazine-2,4,6-triones BAYER AG (DE) 1987-12-09 EP disclosed