SCHEMBL1406429

SCHEMBL1406429

COC(=O)CCC(CCC(=O)OC)(C(C)=O)C(=O)OC

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.48
KMT2A Q03164 2/20 0.42
MEN1 O00255 1/20 0.42
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 1/20 0.39
PTPRB P23467 1/20 0.38
LMNA P02545 3/20 0.36
CA12 O43570 1/20 0.36
CA14 Q9ULX7 1/20 0.36
KDM4E B2RXH2 1/20 0.36
RECQL P46063 1/20 0.36
HSD17B10 Q99714 2/20 0.35
ALDH1A1 P00352 2/20 0.35
MAPT P10636 1/20 0.35
HTT P42858 1/20 0.35
TET2 Q6N021 1/20 0.33
CNR1 P21554 1/20 0.31
CNR2 P34972 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
SCHEMBL1406412 0.93 TSHR (0.48) TSHRKMT2AMEN1MGAMGAA
SCHEMBL12809727 0.92 TSHR (0.44) TSHRKMT2AMEN1MGAMGAA
SCHEMBL12809536 0.90 TSHR (0.43) TSHRKMT2AMEN1MGAMGAA
SCHEMBL14600838 0.89 TSHR (0.55) TSHRKMT2AMEN1MGAMGAA
SCHEMBL16209873 0.89 TSHR (0.55) TSHRKMT2AMEN1MGAMGAA
SCHEMBL24228618 0.85 MEN1 (0.43) TSHRKMT2AMEN1MGAMGAA
SCHEMBL1406422 0.85 DGAT1 (0.42) TSHRKMT2AMEN1MGAMGAA
SCHEMBL27614240 0.83 TSHR (0.39) TSHRKMT2AMEN1MGAMGAA
SCHEMBL12809678 0.82 TSHR (0.39) TSHRKMT2AMEN1MGAMGAA
SCHEMBL12809724 0.81 CYP1A2 (0.44) TSHRKMT2AMEN1MGAMGAA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230312872-A1 PLASTICIZERS FOR CELLULOSE ESTERS 3M INNOVATIVE PROPERTIES COMPANY 2023-10-05 US disclosed
US-20230312872-A1 PLASTICIZERS FOR CELLULOSE ESTERS 3M INNOVATIVE PROPERTIES COMPANY 2023-10-05 US disclosed
WO-2022023841-A1 PLASTICIZERS FOR CELLULOSE ESTERS 3M INNOVATIVE PROPERTIES COMPANY (US) 2022-02-03 WO disclosed
EP-1490412-B1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2011-03-09 EP disclosed
EP-1490412-B1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK & CHEMICALS (JP) 2011-03-09 EP disclosed
EP-1342738-B1 Photocurable composition, process for producing photocurable resin, and crosslinked product DAINIPPON INK & CHEMICALS (JP) 2007-03-07 EP disclosed
US-7166648-B2 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-01-23 US disclosed
US-7166648-B2 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-01-23 US disclosed
US-7166648-B2 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2007-01-23 US disclosed
US-20050256218-A1 Photoinitiator, novel compound, and photocurable composition DAINIPPON INK AND CHEMICALS, INC. (JP) 2005-11-17 US disclosed
EP-1490412-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2004-12-29 EP disclosed
WO-2003082929-A1 PHOTOINITIATOR, NOVEL COMPOUND, AND PHOTOCURABLE COMPOSITION DAINIPPON INK AND CHEMICALS, INC. (JP) 2003-10-09 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-20230312872-A1 PLASTICIZERS FOR CELLULOSE ESTERS CES2, RER1, CETP TSHR 4606/4885KMT2A 2005/4885MEN1 1156/4885

“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.