SCHEMBL4372909

SCHEMBL4372909

C=CNC(=O)C(=C)CN1CCCC1=O

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.51
HTT P42858 1/20 0.46
KMT2A Q03164 2/20 0.40
LMNA P02545 2/20 0.39
BLM P54132 1/20 0.38
PIK3CD O00329 1/20 0.38
ALDH1A1 P00352 1/20 0.37
POLB P06746 1/20 0.37
ATAD2 Q6PL18 1/20 0.36
CECR2 Q9BXF3 1/20 0.36
NPC1 O15118 2/20 0.35
RAB9A P51151 2/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
CYP1A2 P05177 1/20 0.35
CHRM2 P08172 1/20 0.35
CHRM4 P08173 1/20 0.35
CHRM5 P08912 1/20 0.35
CYP2D6 P10635 1/20 0.35
CHRM1 P11229 1/20 0.35
CYP2C9 P11712 1/20 0.35

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
Ethylene SCHEMBL28313751 0.98 TSHR (0.50) TSHRHTTKMT2ALMNABLM
Caprolactam SCHEMBL28605087 0.86 TSHR (0.40) TSHRHTTKMT2ALMNABLM
SCHEMBL16527290 0.84 HTT (0.55) TSHRHTTKMT2ALMNABLM
SCHEMBL27908584 0.82 TSHR (0.36) TSHRHTTKMT2ALMNAALDH1A1
SCHEMBL11760214 0.78 TSHR (0.59) TSHRHTTKMT2ALMNABLM
SCHEMBL28167209 0.77 TSHR (0.50) TSHRHTTKMT2ALMNABLM
SCHEMBL898823 0.75 TSHR (0.39) TSHRHTTKMT2ALMNAPIK3CD
SCHEMBL3103825 0.75 TSHR (0.39) TSHRHTTKMT2ALMNABLM
SCHEMBL917410 0.74 TSHR (0.58) TSHRHTTKMT2ALMNAPIK3CD
SCHEMBL8607333 0.74 LMNA (0.44) TSHRKMT2ALMNABLMPOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110678167-B Cosmetic for dressing 株式会社资生堂 2023-04-04 CN disclosed
CN-113214811-B Efficient natural gas hydrate low-dose compound inhibitor and application thereof 华南理工大学 2022-10-25 CN disclosed
CN-110022852-B Hair dressing composition 株式会社资生堂 2022-08-26 CN disclosed
EP-2838577-A1 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES WITH VISUALIZATION MOIETY SurModics, Inc. (US) 2015-02-25 EP disclosed
US-8956682-B2 Hydrophilic polymeric coatings for medical articles with visualization moiety SURMODICS, INC. (US) 2015-02-17 US disclosed
WO-2013151991-A1 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES WITH VISUALIZATION MOIETY SURMODICS, INC. (US) 2013-10-10 WO disclosed
US-20130261566-A1 HYDROPHILIC POLYMERIC COATINGS FOR MEDICAL ARTICLES WITH VISUALIZATION MOIETY SURMODICS, INC. (US) 2013-10-03 US disclosed
US-8210672-B2 Printing method using inkjet recording method and printing apparatus SEIKO EPSON CORPORATION (JP) 2012-07-03 US disclosed
US-20090295847-A1 PRINTING METHOD USING INKJET RECORDING METHOD AND PRINTING APPARATUS SEIKO EPSON CORPORATION 2009-12-03 US disclosed