SCHEMBL5608488

SCHEMBL5608488

CC(=O)c1nc(C(C)=O)c(C(C)=O)nc1C(C)=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.39
LMNA P02545 2/20 0.36
IKBKB O14920 2/20 0.34
TSHR P16473 1/20 0.33
THPO P40225 1/20 0.33
FFAR3 O14843 1/20 0.33
LCK P06239 1/20 0.33
FYN P06241 1/20 0.33
MAPK1 P28482 1/20 0.31
CASP1 P29466 1/20 0.31
CASP7 P55210 1/20 0.31
CA1 P00915 1/20 0.31
CYP1A2 P05177 1/20 0.31
ALOX15 P16050 1/20 0.31
BLM P54132 1/20 0.31
PMP22 Q01453 1/20 0.31
ALDH1A1 P00352 2/20 0.31
CA5A P35218 1/20 0.30
PDE3B Q13370 1/20 0.30

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
SCHEMBL24589285 0.68 PIN1 (0.37) NPSR1SMN1; SMN2IKBKBCYP1A2ALDH1A1
SCHEMBL8951079 0.61 PDPK1 (0.48) NPSR1LMNAIKBKBLCKMAPK1
Acetone SCHEMBL13343996 0.57
Acetone SCHEMBL528137 0.57 LMNA (1.00) NPSR1LMNATSHRTHPOFFAR3
Acetone SCHEMBL8041527 0.57 LMNA (1.00) NPSR1LMNATSHRTHPOFFAR3
Acetone SCHEMBL10051950 0.57
Acetone SCHEMBL7459124 0.57
Acetone SCHEMBL662 0.57
Acetone SCHEMBL5665105 0.57 LMNA (1.00) NPSR1LMNATSHRTHPOFFAR3
Acetone SCHEMBL10051943 0.57

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-111389394-B Metal monatomic catalyst and preparation method thereof 南方科技大学 2022-10-21 CN claimed
CN-111389394-A Metal monatomic catalyst and preparation method thereof 南方科技大学 2020-07-10 CN claimed
JP-5097640-A None JP disclosed
EP-3781661-B1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2024-03-13 EP disclosed
US-11525106-B2 Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators DOW GLOBAL TECHNOLOGIES LLC (US) 2022-12-13 US disclosed
US-11525106-B2 Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators DOW GLOBAL TECHNOLOGIES LLC (US) 2022-12-13 US disclosed
CN-112400014-B Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators 陶氏环球技术有限责任公司 2022-10-25 CN disclosed
CN-112400014-B Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators 陶氏环球技术有限责任公司 2022-10-25 CN disclosed
CN-111389394-B Metal monatomic catalyst and preparation method thereof 南方科技大学 2022-10-21 CN disclosed
US-20210155877-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC 2021-05-27 US disclosed
US-20210155877-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC 2021-05-27 US disclosed
WO-2019204184-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS DOW GLOBAL TECHNOLOGIES LLC (US) 2019-10-24 WO disclosed
US-7235252-B2 Using excess of hydrogen peroxide PRETO ANDREA 2007-06-26 US disclosed
US-20040002616-A1 Using excess of hydrogen peroxide PRETO ANDREA (IT) 2004-01-01 US disclosed
EP-1371643-A2 Method of preparing organic peroxyacids Preto, Andrea (IT) 2003-12-17 EP disclosed
US-6300303-B1 PHYLLOSILICATE DETERGENT AND CLEANER WITH BULK DENSITY AND PARTICLE SIZES CLARIANT GMBH (DE) 2001-10-09 US disclosed
US-5545349-A Bleaching composition KAO CORPORATION (JP) 1996-08-13 US disclosed
EP-0447553-B1 BLEACHING COMPOSITION KAO CORP (JP) 1996-06-12 EP disclosed
JP-H0597640-A DENTRUE DETERGENT LION CORP 1993-04-20 JP disclosed
EP-0447553-A1 BLEACHING COMPOSITION Kao Corporation (JP) 1991-09-25 EP 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-11525106-B2 Tetraacetyldiamine and triacetyldiamine derivatives useful as bleach activators AADAC, DLAT, NAT10 NPSR1 4486/4885SMN1; SMN2 4650/4885LMNA 4035/4885
US-20040002616-A1 Using excess of hydrogen peroxide ADH1C, HAO2, ADH1A NPSR1 3852/4885SMN1; SMN2 2232/4885LMNA 3403/4885
US-20210155877-A1 TETRAACETYLDIAMINE AND TRIACETYLDIAMINE DERIVATIVES USEFUL AS BLEACH ACTIVATORS AADAC, DLAT, NAT10 NPSR1 4486/4885SMN1; SMN2 4650/4885LMNA 4035/4885

“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.