SCHEMBL225261

SCHEMBL225261

CCOC(=O)c1c(N)sc(N=Cc2ccc(N(CC)CC)s2)c1C(=O)OCC

nearest known ligand 0.65

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTPN1 P18031 5/20 0.65
MAPT P10636 9/20 0.47
GAA P10253 8/20 0.47
ALDH1A1 P00352 7/20 0.47
HPGD P15428 4/20 0.47
SMN1; SMN2 Q16637 2/20 0.47
FHIT P49789 1/20 0.44
HTT P42858 1/20 0.40
KDM4E B2RXH2 4/20 0.40
ALOX15 P16050 1/20 0.40
TSHR P16473 1/20 0.40
ALOX12 P18054 1/20 0.40
HSD17B10 Q99714 1/20 0.40
GRM6 O15303 2/20 0.40
NPSR1 Q6W5P4 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39

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
SCHEMBL225260 1.00 PTPN1 (0.65) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL223063 0.92 PTPN1 (0.53) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL14340738 0.88 PTPN1 (0.49) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL222432 0.83 MAPT (0.52) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL222431 0.83 MAPT (0.52) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL223084 0.80 PTPN1 (0.69) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL223085 0.80 PTPN1 (0.69) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL225494 0.79 PTPN1 (1.00) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL225493 0.79 PTPN1 (1.00) PTPN1MAPTGAAALDH1A1HPGD
SCHEMBL12204893 0.78 PTPN1 (0.77) PTPN1MAPTGAAALDH1A1HPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120004386-A1 CONJUGATED THIOPHENES HAVING CONDUCTING PROPERTIES AND SYNTHESIS OF SAME UNIVERSITE DE MONTREAL (CA) 2012-01-05 US disclosed
US-8034895-B2 Conjugated thiophenes having conducting properties and synthesis of same Université de Montréal (CA) 2011-10-11 US disclosed
US-20070287842-A1 Conjugated Thiophenes Having Conducting Properties and Synthesis of Same UNIVERSITE DE MONTREAL (CA) 2007-12-13 US disclosed
WO-2005073265-A1 CONJUGATED THIOPHENES HAVING CONDUCTING PROPERTIES AND SYNTHESIS OF SAME UNIVERSITE DE MONTREAL (CA) 2005-08-11 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-20070287842-A1 Conjugated Thiophenes Having Conducting Properties and Synthesis of Same DDT, DDC, TRPA1 PTPN1 945/4885MAPT 233/4885GAA 2887/4885

“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.