SCHEMBL13611359

SCHEMBL13611359

O=C1C=C(OCCCCCCOC2=CC(=O)c3ccccc3C2=O)c2ccccc2C1=O

nearest known ligand 0.69

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 4/20 0.69
PTPRC P08575 2/20 0.61
CDC25B P30305 2/20 0.61
IDO1 P14902 1/20 0.53
CDC25A P30304 1/20 0.53
CES2 O00748 7/20 0.50
CES1 P23141 7/20 0.50
GAPDH P04406 1/20 0.50
S100A4 P26447 1/20 0.41
MALT1 Q9UDY8 2/20 0.41
KDM4E B2RXH2 1/20 0.41
ALDH1A1 P00352 1/20 0.41
CYP3A4 P08684 1/20 0.41
MAPT P10636 1/20 0.41
HPGD P15428 1/20 0.41
MAPK1 P28482 1/20 0.41
PTPN22 Q9Y2R2 1/20 0.41

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
SCHEMBL14439325 0.87 PTPRC (0.65) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL9628579 0.86 CDC25B (0.56) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL14764883 0.86 CDC25B (0.51) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL9713908 0.86 CDC25B (0.56) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL4291302 0.86 PTPN1 (0.88) PTPN1PTPRCCDC25BCES2CES1
SCHEMBL10446698 0.86 PTPN1 (0.68) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL4299667 0.86 PTPN1 (0.68) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL5595788 0.86 PTPN1 (0.68) PTPN1PTPRCCDC25BIDO1CDC25A
SCHEMBL5595746 0.86 PTPRC (0.69) PTPN1PTPRCCDC25BCES2CES1
SCHEMBL5595620 0.86 PTPRC (0.69) PTPN1PTPRCCDC25BCES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES PROGEN PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES PROGEN PHARMACEUTICALS, INC. 2009-11-05 US disclosed
US-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CELLGATE, INC. 2008-08-14 US disclosed
US-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CELLGATE, INC. 2008-08-14 US disclosed
US-7279502-B2 Polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CELLGATE, INC. (US) 2007-10-09 US disclosed
US-7279502-B2 Polyamine analog conjugates and quinone conjugates as therapies for cancers and prostate diseases CELLGATE, INC. (US) 2007-10-09 US disclosed
US-7253207-B2 Quinones as disease therapies CELLGATE, INC. (US) 2007-08-07 US disclosed
US-7253207-B2 Quinones as disease therapies CELLGATE, INC. (US) 2007-08-07 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 (2 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-20080194697-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CTSB, KLK3, FOLH1 PTPN1 3701/4885PTPRC 1472/4885CDC25B 190/4885
US-20090275664-A1 NOVEL POLYAMINE ANALOG CONJUGATES AND QUINONE CONJUGATES AS THERAPIES FOR CANCERS AND PROSTATE DISEASES CTSB, CTSL, CTSV PTPN1 4034/4885PTPRC 1675/4885CDC25B 511/4885

“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.