SCHEMBL241097

SCHEMBL241097

NC(=O)c1ccnc(CCO)c1CCO

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.38
L3MBTL1 Q9Y468 2/20 0.38
PARP1 P09874 1/20 0.34
SIRT1 Q96EB6 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HPGD P15428 1/20 0.33
HSD17B10 Q99714 1/20 0.33
SIRT3 Q9NTG7 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
CDC7 O00311 1/20 0.32
SYK P43405 2/20 0.32
PIK3CB P42338 1/20 0.31
DYRK1B Q9Y463 2/20 0.31
CSNK1A1 P48729 1/20 0.31
TYRO3 Q06418 1/20 0.31
STAT6 P42226 1/20 0.31
BCAT2 O15382 1/20 0.31
MAP2K1 Q02750 1/20 0.31
CLK4 Q9HAZ1 1/20 0.31
NUDT1 P36639 1/20 0.31

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
SCHEMBL8945357 0.83 KDM4E (0.38) KDM4EL3MBTL1PARP1SIRT1ALDH1A1
SCHEMBL8595993 0.79 KDM4E (0.40) KDM4EL3MBTL1PARP1ALDH1A1HPGD
SCHEMBL62707 0.77 PARP1 (0.50) KDM4EL3MBTL1PARP1SIRT1ALDH1A1
SCHEMBL29421066 0.77 SIRT1 (0.39) KDM4EPARP1SIRT1ALDH1A1HPGD
SCHEMBL7109139 0.77 SIRT1 (0.39) KDM4EPARP1SIRT1ALDH1A1HPGD
Hydrochloric Acid SCHEMBL30786354 0.76 PARP1 (0.49) KDM4EL3MBTL1PARP1SIRT1ALDH1A1
SCHEMBL8597943 0.74 KDM4E (0.40) KDM4EL3MBTL1PARP1ALDH1A1HPGD
SCHEMBL27800518 0.74 SIRT1 (0.47) KDM4EPARP1SIRT1ALDH1A1HPGD
SCHEMBL4745637 0.72 KMT2A (0.31)
SCHEMBL27583503 0.72 ADORA3 (0.36) ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090093606-A1 Shape memory fibers prepared via wet, reaction, dry, melt, and electro spinning THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2009-04-09 US claimed
EP-3807334-A1 POLYURETHANE-ORGANOPOLYSILOXANES HAVING CARBODIIMIDE GROUPS CHT Germany GmbH (DE) 2021-04-21 EP disclosed
EP-3747301-A1 FOOTWEAR AND OTHER ARTICLES FORMED BY JET EXTRUSION PROCESSES The North Face Apparel Corp. (US) 2020-12-09 EP disclosed
EP-3271508-B1 FLUORINE-FREE HYDROPHOBIZATION CHT Germany GmbH (DE) 2020-10-28 EP disclosed
US-10793983-B2 Footwear and other articles formed by jet extrusion processes THE NORTH FACE APPAREL CORP. (US) 2020-10-06 US disclosed
WO-2019242997-A1 POLYURETHANE-ORGANOPOLYSILOXANES HAVING CARBODIIMIDE GROUPS CHT Germany GmbH (DE) 2019-12-26 WO disclosed
US-20170306539-A1 FOOTWEAR AND OTHER ARTICLES FORMED BY JET EXTRUSION PROCESSES THE NORTH FACE APPAREL CORP. (US) 2017-10-26 US disclosed
US-9222203-B2 Items of clothing having shape memory THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2015-12-29 US disclosed
CN-103298848-B The oligomeric bromination carbamate composition of flame retardant resistance LUBRIZOL ADVANCED MATERIALS, INC. (US) 2015-07-29 CN disclosed
CN-102585152-B Preparation method of self-emulsified ionic waterborne polyurethane UNIV SHANGHAI 2013-10-16 CN disclosed
US-20120000251-A1 ITEMS OF CLOTHING HAVING SHAPE MEMORY THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2012-01-05 US disclosed
US-20090093606-A1 Shape memory fibers prepared via wet, reaction, dry, melt, and electro spinning THE HONG KONG POLYTECHNIC UNIVERSITY (HK) 2009-04-09 US disclosed