SCHEMBL14656756

SCHEMBL14656756

O=Cc1csc(-c2ccsc2-c2cccs2)c1C=O

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ERN1 O75460 6/20 0.39
DPP4 P27487 1/20 0.36
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
GAA P10253 1/20 0.33
MAPT P10636 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33
HSD17B10 Q99714 1/20 0.33
CYP2A6 P11509 2/20 0.33
LMNA P02545 1/20 0.32
CES1 P23141 1/20 0.31
PTGS1 P23219 1/20 0.31
PTPRC P08575 1/20 0.30

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
SCHEMBL246872 0.88 ERN1 (0.45) ERN1DPP4KDM4EALDH1A1GAA
SCHEMBL5804669 0.78 KDM4E (0.30) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL498579 0.78 DPP4 (0.55) ERN1DPP4KDM4EALDH1A1GAA
SCHEMBL9231804 0.76 ERN1 (0.49) ERN1DPP4KDM4EALDH1A1GAA
SCHEMBL10551506 0.74 ERN1 (0.45) ERN1DPP4KDM4EALDH1A1MAPT
SCHEMBL10551507 0.73 ERN1 (0.44) ERN1DPP4KDM4EALDH1A1GAA
SCHEMBL2783306 0.72 TRPA1 (0.33) MAPTLMNA
SCHEMBL22734772 0.71 PTPRC (0.41) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22734807 0.71 PTPRC (0.41) KDM4EALDH1A1GAAMAPTHPGD
SCHEMBL22763310 0.71 PTPRC (0.41) KDM4EALDH1A1GAAMAPTHPGD

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2559720-A1 CROSSLINKED COMPOSITION Daicel Corporation (JP) 2013-02-20 EP disclosed
US-20130026458-A1 CROSSLINKABLE COMPOSITION DAICEL CORPORATION (JP) 2013-01-31 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 (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-20130026458-A1 CROSSLINKABLE COMPOSITION DDC, ODC1, SRM ERN1 1867/4885DPP4 4713/4885KDM4E 901/4885

“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.