SCHEMBL2172658

SCHEMBL2172658

O=C1NC(=O)c2c(SS)cccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 2/20 0.46
▸ PARP1 P09874 5/20 0.44
▸ KDM4E B2RXH2 6/20 0.44
▸ ALDH1A1 P00352 4/20 0.44
▸ HPGD P15428 2/20 0.44
▸ HSD17B10 Q99714 2/20 0.44
▸ GAA P10253 1/20 0.44
▸ CASP3 P42574 4/20 0.41
▸ CASP7 P55210 2/20 0.41
▸ CASP2 P42575 1/20 0.41
▸ CASP6 P55212 1/20 0.41
▸ CASP8 Q14790 1/20 0.41
▸ POLB P06746 3/20 0.37
▸ NPSR1 Q6W5P4 2/20 0.37
▸ MEN1 O00255 2/20 0.37
▸ KMT2A Q03164 2/20 0.37
▸ MAPT P10636 2/20 0.37
▸ RGS12 O14924 1/20 0.37
▸ USP2 O75604 1/20 0.37
▸ CYP1A2 P05177 1/20 0.37

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
SCHEMBL5074783 0.84 GSK3B (0.50) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL7078965 0.84 GSK3B (0.50) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL30091416 0.84 GSK3B (0.50) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL1024613 0.81 GSK3B (0.46) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL17474487 0.81 GSK3B (0.46) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL4421846 0.81 KDM4E (0.47) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL4590268 0.78 KDM4E (0.45) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL29016392 0.78 GSK3B (0.43) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL16754925 0.77 GSK3B (0.62) GSK3BPARP1KDM4EALDH1A1HPGD
SCHEMBL52296 0.77 KDM4E (0.62) GSK3BPARP1KDM4EALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114315689-B Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2023-04-07 — — CN claimed
CN-115724786-A Amide alkane dithiophthalimide compound, preparation method and application thereof 四川大学 2023-03-03 — — CN claimed
CN-114315689-A Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2022-04-12 — — CN claimed
JP-2007505922-A — — 2007-03-15 — — JP claimed
US-20060211728-A1 Thalidomide analogs P2D INC. 2006-09-21 — — US claimed
EP-1663223-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, represented by THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2006-06-07 — — EP claimed
WO-2005028436-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-03-31 — — WO claimed
CN-115724786-B Amidedithiophthalimide compound, preparation method and application thereof 四川大学 2024-01-30 — — CN disclosed
CN-114315689-B Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2023-04-07 — — CN disclosed
CN-114315689-B Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2023-04-07 — — CN disclosed
CN-114315689-B Disulfanylphthalimide compound, preparation method and application thereof 四川大学 2023-04-07 — — CN disclosed
CN-115724786-A Amide alkane dithiophthalimide compound, preparation method and application thereof 四川大学 2023-03-03 — — CN disclosed
CN-115724786-A Amide alkane dithiophthalimide compound, preparation method and application thereof 四川大学 2023-03-03 — — CN disclosed
US-8546430-B2 Thalidomide analogs P2D, INC. (US) 2013-10-01 — — US disclosed
US-20130035363-A1 Thalidomide Analogs THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2013-02-07 — — US disclosed
US-20110245210-A1 THALIDOMIDE ANALOGS The Government of the United States of America, as represented by the Secretary of 2011-10-06 — — US disclosed
US-7973057-B2 Thalidomide analogs THE UNITED STATES OF AMERICA AS REPRESENTED BY THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2011-07-05 — — US disclosed
US-20060211728-A1 Thalidomide analogs P2D INC. 2006-09-21 — — US disclosed
EP-1663223-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, represented by THE DEPARTMENT OF HEALTH & HUMAN SERVICES (US) 2006-06-07 — — EP disclosed
WO-2005028436-A2 THALIDOMIDE ANALOGS AS TNF-ALPHA MODULATORS THE GOVERNMENT OF THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF THE DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) 2005-03-31 — — 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-20130035363-A1 Thalidomide Analogs TNF, TNFRSF1A, TNFRSF9 GSK3B 2350/4885PARP1 1881/4885KDM4E 2768/4885
US-20060211728-A1 Thalidomide analogs TNF, TNFRSF1A, PGF GSK3B 3325/4885PARP1 2561/4885KDM4E 3440/4885
US-20110245210-A1 THALIDOMIDE ANALOGS TNF, TNFRSF1A, PGF GSK3B 3325/4885PARP1 2561/4885KDM4E 3440/4885

“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.

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