SCHEMBL5457230

SCHEMBL5457230

O=C(CN1C(=O)CSC1=O)Nc1ccccc1

nearest known ligand 0.78

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.78
HSD17B10 Q99714 2/20 0.78
MEN1 O00255 3/20 0.75
KMT2A Q03164 3/20 0.75
TSHR P16473 3/20 0.75
SMN1; SMN2 Q16637 1/20 0.75
GFER P55789 1/20 0.71
GAA P10253 2/20 0.70
MAPT P10636 2/20 0.68
HPGD P15428 1/20 0.68
POLB P06746 1/20 0.67
NPSR1 Q6W5P4 1/20 0.64
USP2 O75604 1/20 0.57
HTT P42858 1/20 0.54
GSK3A P49840 1/20 0.53
GSK3B P49841 1/20 0.53

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
SCHEMBL16671708 0.86 ALDH1A1 (1.00) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL5468600 0.78 GSK3A (0.66) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL14492360 0.77 GSK3A (0.73) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL5455140 0.76 HDAC1 (0.70) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL5457428 0.76 MEN1 (0.65) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL12177294 0.75 ALDH1A1 (0.69) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL9327964 0.74 KMT2A (0.68) ALDH1A1MEN1KMT2ASMN1; SMN2HPGD
SCHEMBL5465566 0.74 GAA (0.60) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL9825516 0.73 HTT (0.61) ALDH1A1HSD17B10MEN1KMT2ATSHR
SCHEMBL1421312 0.73 GSK3A (0.67) ALDH1A1HSD17B10MEN1KMT2ATSHR

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
US-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor INSTITUTE OF MEDICINAL MOLECULAR DESIGN. INC. (JP) 2007-11-29 US disclosed
EP-1666469-A1 PLASMINOGEN ACTIVATOR INHIBITOR-1 INHIBITOR Institute of Medicinal Molecular Design, Inc. (JP) 2006-06-07 EP 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-20070276011-A1 Plasminogen Activator Inhibitor-1 Inhibitor SERPINE1, SERPINC1, SERPINB1 ALDH1A1 1861/4885HSD17B10 2022/4885MEN1 2892/4885

“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.