SCHEMBL2405059

SCHEMBL2405059

C=CC(N)CC(=O)c1ccccc1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.53
L3MBTL1 Q9Y468 6/20 0.47
MAPT P10636 4/20 0.47
ALDH1A1 P00352 4/20 0.47
SMN1; SMN2 Q16637 3/20 0.47
LMNA P02545 3/20 0.47
HPGD P15428 2/20 0.47
KMT2A Q03164 4/20 0.47
MEN1 O00255 3/20 0.47
KDM4E B2RXH2 2/20 0.47
MAPK1 P28482 2/20 0.47
TDP1 Q9NUW8 2/20 0.47
CYP3A4 P08684 1/20 0.47
ALOX15 P16050 1/20 0.47
CES1 P23141 1/20 0.47
NPSR1 Q6W5P4 2/20 0.46
NPC1 O15118 1/20 0.45
GSK3B P49841 2/20 0.44
PTPN1 P18031 2/20 0.44
TRPA1 O75762 1/20 0.44

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
SCHEMBL1414563 0.79 TSHR (0.55) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL10587782 0.79 TSHR (0.50) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL10517046 0.78 TSHR (0.63) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL19346894 0.78 L3MBTL1 (0.56) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL7882975 0.78 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL7203018 0.78 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL11762210 0.78 TSHR (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL15304002 0.77 ALDH1A1 (0.59) TSHRL3MBTL1ALDH1A1LMNAHPGD
SCHEMBL11088941 0.76 ALDH1A1 (0.53) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2
SCHEMBL6425252 0.76 TSHR (0.61) TSHRL3MBTL1MAPTALDH1A1SMN1; SMN2

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-111393781-A Water-based bead blasting wall material for cigarettes and preparation method thereof 武汉市昱宸峰科技有限公司 2020-07-10 CN claimed
CN-111393781-A Water-based bead blasting wall material for cigarettes and preparation method thereof 武汉市昱宸峰科技有限公司 2020-07-10 CN disclosed
CN-102791365-B Polyamide membrane with a coating comprising polyalkylene oxide and acetophenone compounds DOW GLOBAL TECHNOLOGIES LLC 2014-12-24 CN disclosed
US-8721942-B2 Composite membrane including coating of polyalkylene oxide and acetophenone compounds DOW GLOBAL TECHNOLOGIES LLC (US) 2014-05-13 US disclosed
CN-102791365-A Polyamide membrane with a coating comprising polyalkylene oxide and acetophenone compounds DOW GLOBAL TECHNOLOGIES LLC 2012-11-21 CN disclosed
WO-2011112351-A1 POLYAMIDE MEMBRANE WITH A COATING COMPRISING POLYALKYLENE OXIDE AND ACETOPHENONE COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC (US) 2011-09-15 WO disclosed
US-20110220569-A1 COMPOSITE MEMBRANE INCLUDING COATING OF POLYALKYLENE OXIDE AND ACETOPHENONE COMPOUNDS DOW GLOBAL TECHNOLOGIES LLC 2011-09-15 US disclosed
US-20080027075-A1 Quaternary Amino-Function Chalcones LICA PHARMACEUTICALS A/S (DK) 2008-01-31 US disclosed
EP-1682486-A1 QUATERNARY AMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2006-07-26 EP disclosed
US-20060052600-A1 Amino-functional chalcones LICA PHARMACEUTICALS A/S (DK) 2006-03-09 US disclosed
WO-2005042467-A1 QUATERNARY AMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2005-05-12 WO disclosed
EP-1506157-A2 AMINO-FUNCTIONAL CHALCONES Lica Pharmaceuticals A/S (DK) 2005-02-16 EP disclosed
WO-2003097575-A2 AMINO-FUNCTIONAL CHALCONES LICA PHARMACEUTICALS A/S (DK) 2003-11-27 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 (1 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-20080027075-A1 Quaternary Amino-Function Chalcones NR2E1, BET1, NR0B1 TSHR 2635/4885L3MBTL1 2008/4885MAPT 4666/4885

“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.