SCHEMBL4447273

SCHEMBL4447273

CCCN1C(=O)CN(C)C1=O

nearest known ligand 0.50

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
PLA2G7 Q13093 1/20 0.50
HDAC6 Q9UBN7 2/20 0.41
ALDH1A1 P00352 3/20 0.41
RECQL P46063 1/20 0.41
MEN1 O00255 1/20 0.35
KMT2A Q03164 1/20 0.35
GFER P55789 1/20 0.35
F2 P00734 1/20 0.35
ELANE P08246 1/20 0.35
CTSG P08311 1/20 0.35
CTRC Q99895 1/20 0.35
NR1H2 P55055 2/20 0.34
L3MBTL1 Q9Y468 1/20 0.34
CYP19A1 P11511 3/20 0.34
NR1H3 Q13133 1/20 0.34
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
ATAD2 Q6PL18 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
SCHEMBL17213445 0.87 PLA2G7 (0.47) PLA2G7HDAC6ALDH1A1RECQLNR1H2
SCHEMBL13204644 0.85 MGLL (0.47) PLA2G7HDAC6ALDH1A1NR1H2CYP19A1
SCHEMBL414553 0.84 F2 (0.48) PLA2G7HDAC6ALDH1A1RECQLMEN1
SCHEMBL11264830 0.84 MGLL (0.50) PLA2G7ALDH1A1CYP19A1
SCHEMBL11252578 0.84 MGLL (0.50) PLA2G7ALDH1A1CYP19A1
SCHEMBL30372493 0.84 MGLL (0.50) PLA2G7ALDH1A1CYP19A1
SCHEMBL24738599 0.80 PLA2G7 (0.49) PLA2G7HDAC6ALDH1A1RECQLMEN1
SCHEMBL7291993 0.80 PLA2G7 (0.49) PLA2G7HDAC6ALDH1A1RECQLMEN1
SCHEMBL22702280 0.80 PLA2G7 (0.49) PLA2G7HDAC6ALDH1A1RECQLMEN1
SCHEMBL13853160 0.80 HDAC6 (0.50) PLA2G7HDAC6F2ELANECTSG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112593251-B Electrochemical reaction device 株式会社东芝 2024-02-09 CN disclosed
CN-116194211-A Method and apparatus for producing ammonia 日产化学株式会社 2023-05-30 CN disclosed
EP-2931280-B1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS INC (US) 2018-02-14 EP disclosed
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-10-20 US disclosed
US-9340532-B2 Methods and compositions for inhibiting CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2016-05-17 US disclosed
US-20150307482-A1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2015-10-29 US disclosed
US-9139609-B2 C-4″ position substituted macrolide derivative TAISHO PHARMACEUTICAL CO., LTD. (JP) 2015-09-22 US disclosed
WO-2014093988-A2 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 PHUSIS THERAPEUTICS, INC. (US) 2014-06-19 WO disclosed
US-20140046043-A1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE MEIJI SEIKA PHARMA CO., LTD. (JP) 2014-02-13 US disclosed
EP-1778008-A4 NOVEL SOLID COMPOSITIONS FOR DISINFECTING WATER BROMINE COMPOUNDS LTD (IL) 2009-08-26 EP disclosed
US-20080038303-A1 Novel Solid Compositions for Disinfected Water BROMINE COMPOUNDS LTD. (IL) 2008-02-14 US disclosed
EP-1778008-A2 NOVEL SOLID COMPOSITIONS FOR DISINFECTING WATER Bromine Compounds Ltd. (IL) 2007-05-02 EP disclosed
WO-2006006155-A2 NOVEL SOLID COMPOSITIONS FOR DISINFECTING WATER BROMINE COMPOUNDS LTD. (IL) 2006-01-19 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (3 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20150307482-A1 METHODS AND COMPOSITIONS FOR INHIBITING CNKSR1 CNKSR1, CAMKK1, CAMKK2 PLA2G7 1691/4885HDAC6 2725/4885ALDH1A1 4764/4885
US-20160304533-A1 COMPOUNDS, COMPOSITIONS AND METHODS FOR INHIBITING CNKSR1 CNKSR1, CAMKK1, CNR1 PLA2G7 1406/4885HDAC6 1690/4885ALDH1A1 4731/4885
US-20140046043-A1 C-4\" POSITION SUBSTITUTED MACROLIDE DERIVATIVE MRPL21, MRPS34, MRPL37 PLA2G7 4284/4885HDAC6 783/4885ALDH1A1 4667/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.