SCHEMBL1905722

SCHEMBL1905722

O=C1CSC(=S)N1n1cccn1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 7/20 0.41
▸ MAPT P10636 5/20 0.41
▸ RECQL P46063 5/20 0.41
▸ ALDH1A1 P00352 4/20 0.41
▸ HSD17B10 Q99714 3/20 0.41
▸ GSK3A P49840 4/20 0.39
▸ GSK3B P49841 4/20 0.39
▸ HTT P42858 3/20 0.39
▸ MEN1 O00255 10/20 0.38
▸ KMT2A Q03164 10/20 0.38
▸ TDP1 Q9NUW8 2/20 0.38
▸ LMNA P02545 1/20 0.38
▸ TP53 P04637 1/20 0.38
▸ THRB P10828 1/20 0.38
▸ ALOX15 P16050 1/20 0.38
▸ MAPK1 P28482 1/20 0.38
▸ L3MBTL1 Q9Y468 1/20 0.38
▸ POLB P06746 3/20 0.37
▸ APEX1 P27695 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL22609498 0.69 — —
SCHEMBL1607021 0.68 GSK3A (0.52) GAAMAPTRECQLALDH1A1HSD17B10
SCHEMBL17144505 0.63 GSK3A (0.47) GAAMAPTRECQLALDH1A1HSD17B10
SCHEMBL14437016 0.61 GSK3A (0.40) GAAMAPTRECQLALDH1A1HSD17B10
SCHEMBL9464929 0.61 NOS1 (0.38) GAAMAPTALDH1A1MEN1KMT2A
SCHEMBL29088611 0.60 BRD4 (0.33) —
SCHEMBL13738187 0.60 GSK3A (0.42) GAAMAPTRECQLALDH1A1HSD17B10
SCHEMBL21047619 0.58 LMNA (0.32) LMNA
SCHEMBL28521186 0.58 — —
SCHEMBL4541893 0.58 RECQL (0.41) GAAMAPTRECQLALDH1A1HSD17B10

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-7947717-B2 Inhibitors of lethal factor protease BURNHAM INSTITUTE FOR MEDICAL RESEARCH (US) 2011-05-24 — — US disclosed
US-20100016292-A1 INHIBITORS OF LETHAL FACTOR PROTEASE THE BURNHAM INSTITUTE (US) 2010-01-21 — — 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-20100016292-A1 INHIBITORS OF LETHAL FACTOR PROTEASE APAF1, F11, SERPINB1 GAA 192/4885MAPT 2957/4885RECQL 3071/4885

“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.

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