SCHEMBL3081982

SCHEMBL3081982

O=C1CSC(=S)N1CCCN1CCOCC1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.51
KMT2A Q03164 3/20 0.51
GAA P10253 3/20 0.51
ALDH1A1 P00352 2/20 0.47
GSK3A P49840 6/20 0.46
GSK3B P49841 6/20 0.46
KDM1A O60341 3/20 0.43
RECQL P46063 1/20 0.43
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
HTR6 P50406 1/20 0.40
KEAP1 Q14145 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
PAX8 Q06710 1/20 0.39
TNFRSF1A P19438 1/20 0.38
KDM4E B2RXH2 1/20 0.37
MAPT P10636 1/20 0.37
PKM P14618 1/20 0.37
APOBEC3G Q9HC16 1/20 0.37
TDP1 Q9NUW8 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
SCHEMBL4579816 0.92 GSK3A (0.49) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL3062340 0.76 GSK3A (0.62) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL30479909 0.76 MAPT (0.49) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL9470544 0.75 KEAP1 (0.48) KDM1AHTR1ADRD2HTR6KEAP1
SCHEMBL186221 0.72 MEN1 (0.62) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL11022809 0.72 MEN1 (0.57) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL14850663 0.71 MEN1 (0.65) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL28886326 0.71 MEN1 (0.65) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL16274020 0.71 MEN1 (0.65) MEN1KMT2AGAAALDH1A1GSK3A
SCHEMBL20176213 0.71 MEN1 (0.65) MEN1KMT2AGAAALDH1A1GSK3A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7795255-B2 Rigidified compounds for modulating heparanase activity INSIGHT BIOPHARMACEUTICALS LTD. (IL) 2010-09-14 US disclosed
EP-1830848-B1 USE OF THIAZOLIDINONE DERIVATIVES FOR THE TREATMENT OF SOLID TUMORS CELL THERAPEUTICS EUROPE SRL (IT) 2009-12-16 EP disclosed
US-20080261980-A1 Use of Thiazolidinone Derivatives as Antiangiogenic Agents CELL THERAPEUTICS, INC. (US) 2008-10-23 US disclosed
US-20080039456-A1 Rigidified Compounds for Modulating Heparanase Activity INSIGHT BIOPHARMACEUTICALS LTD. (IL) 2008-02-14 US disclosed
EP-1846383-A2 RIGIDIFIED COMPOUNDS FOR MODULATING HEPARANASE ACTIVITY Insight Biopharmaceuticals Ltd. (IL) 2007-10-24 EP disclosed
EP-1830848-A1 USE OF THIAZOLIDINONE DERIVATIVES AS ANTIANGIOGENIC AGENTS Cell Therapeutics Europe S.R.L. (IT) 2007-09-12 EP disclosed
WO-2006072953-A2 RIGIDIFIED COMPOUNDS FOR MODULATING HEPARANASE ACTIVITY INSIGHT BIOPHARMACEUTICALS LTD. (IL) 2006-07-13 WO disclosed
WO-2006066846-A1 USE OF THIAZOLIDINONE DERIVATIVES AS ANTIANGIOGENIC AGENTS CELL THERAPEUTICS EUROPE S.R.L. (IT) 2006-06-29 WO disclosed
US-20040002526-A1 Phospholipase D inhibitors and uses thereof CELL THERAPEUTICS, INC. 2004-01-01 US 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-20040002526-A1 Phospholipase D inhibitors and uses thereof PLD2, PLD1, PLA2G2D MEN1 3009/4885KMT2A 3403/4885GAA 1550/4885
US-20080261980-A1 Use of Thiazolidinone Derivatives as Antiangiogenic Agents EP300, HIF1A, HIF1AN MEN1 2216/4885KMT2A 1040/4885GAA 1739/4885
US-20080039456-A1 Rigidified Compounds for Modulating Heparanase Activity HPSE, HEXA, GAA MEN1 3219/4885KMT2A 1428/4885GAA 3/4885

“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.