SCHEMBL3101475

SCHEMBL3101475

C=CC(=O)OC(C#N)CCC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.39
HPGD P15428 1/20 0.39
THRB P10828 3/20 0.33
ALDH1A1 P00352 5/20 0.32
TP53 P04637 3/20 0.32
HIF1A Q16665 3/20 0.32
CYP3A4 P08684 2/20 0.32
MAPK1 P28482 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
EPHX2 P34913 1/20 0.32
ZDHHC20 Q5W0Z9 2/20 0.31
ZDHHC2 Q9UIJ5 1/20 0.31
HDAC7 Q8WUI4 1/20 0.31
HDAC8 Q9BY41 1/20 0.31
HDAC6 Q9UBN7 1/20 0.31
HDAC9 Q9UKV0 1/20 0.31
HDAC5 Q9UQL6 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL8158338 0.94 TSHR (0.42) TSHRHPGDTHRBALDH1A1EPHX2
Ether SCHEMBL9332239 0.94 TSHR (0.36) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL11774081 0.91 TSHR (0.49) TSHRHPGDTHRBALDH1A1CYP3A4
Methacrylic Acid SCHEMBL27993448 0.91 TSHR (0.34) TSHRHPGD
SCHEMBL6061300 0.90 TSHR (0.44) TSHRHPGDTHRBALDH1A1EPHX2
SCHEMBL6407967 0.88 TSHR (0.43) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL4921452 0.88 TSHR (0.43) TSHRHPGDTHRBALDH1A1CYP3A4
SCHEMBL529992 0.85 TSHR (0.38) TSHRHPGDTHRBALDH1A1TP53
SCHEMBL14659615 0.79 HDAC7 (0.33) TSHRALDH1A1CYP3A4EPHX2HDAC7
Acrylic Acid Methyl Ester SCHEMBL28023000 0.79 TSHR (0.34) TSHRHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110233235-B Negative pole piece and electrochemical device 宁德时代新能源科技股份有限公司 2021-08-20 CN claimed
CN-109428080-B Negative electrode binder, negative electrode plate and lithium ion secondary battery 宁德时代新能源科技股份有限公司 2020-11-06 CN claimed
CN-105533856-A Low-resistance particle-filtering protective gauze mask with helical structures LI GUOZHEN 2016-05-04 CN claimed
CN-105498412-A Low-energy-consumption air filtration device provided with spiral structures and air purifier LI GUOZHEN 2016-04-20 CN claimed
CN-105413082-A Air filtering device with helical structure and helical filtering nose plug LI GUOZHEN 2016-03-23 CN claimed
US-20060121387-A1 Toner processes XEROX CORPORATION 2006-06-08 US claimed
US-6664017-B1 Document security processes XEROX CORPORATION 2003-12-16 US claimed
US-5385803-A Authentication process XEROX CORPORATION (US) 1995-01-31 US claimed
US-5334471-A Free-flowing toner comprising a mixture of shell-core polymers , low remanence magnetite and light scattering component XEROX CORPORATION (US) 1994-08-02 US claimed
US-5304448-A Encapsulated toner compositions XEROX CORPORATION (US) 1994-04-19 US claimed
US-5175071-A Encapsulated toner composition XEROX CORPORATION (US) 1992-12-29 US claimed
US-5153093-A Overcoated encapsulated toner compositions and processes thereof XEROX CORPORATION (US) 1992-10-06 US claimed
US-5153089-A Encapsulated toner compositions and processes thereof XEROX CORPORATION (US) 1992-10-06 US claimed
US-5147744-A MICR processes with colored encapsulated compositions XEROX CORPORATION (US) 1992-09-15 US claimed
US-5135832-A COLORED TONER COMPOSITIONS XEROX CORPORATION (US) 1992-08-04 US claimed
US-5114819-A Magnetic encapsulated toner compositions XEROX CORPORATION (US) 1992-05-19 US claimed
US-5082757-A Encapsulated toner compositions XEROX CORPORATION (US) 1992-01-21 US claimed
US-5080986-A Magnetic image character recognition processes with encapsulated toners XEROX CORPORATION (US) 1992-01-14 US claimed
US-5077167-A Encapsulated toner compositions XEROX CORPORATION (US) 1991-12-31 US claimed
US-5043240-A Encapsulated toner compositions XEROX CORPORATION (US) 1991-08-27 US claimed