SCHEMBL26794062

SCHEMBL26794062

O=C1/C(=C/c2c[nH]c3ccccc23)SC(=S)N1CCCCCS(=O)(=O)O

nearest known ligand 0.52

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FFAR1 O14842 2/20 0.52
▸ DUSP3 P51452 6/20 0.45
▸ DNMT1 P26358 1/20 0.45
▸ PKM P14618 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ PTPRC P08575 1/20 0.41
▸ PTPN1 P18031 1/20 0.41
▸ DUSP1 P28562 1/20 0.41
▸ CDC25A P30304 1/20 0.41
▸ PTPN7 P35236 1/20 0.41
▸ CISD1 Q9NZ45 2/20 0.41
▸ MAOA P21397 1/20 0.41
▸ KDM4E B2RXH2 2/20 0.41
▸ MAPT P10636 2/20 0.41
▸ LMNA P02545 1/20 0.41
▸ THRB P10828 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
SCHEMBL29727851 1.00 FFAR1 (0.52) FFAR1DUSP3DNMT1PKMPOLB
SCHEMBL13236136 0.85 FFAR1 (0.71) FFAR1DNMT1PKMPOLBPTPN1
SCHEMBL26661588 0.85 FFAR1 (0.52) FFAR1POLBCISD1MAOAKDM4E
SCHEMBL26794059 0.85 FFAR1 (0.59) FFAR1DNMT1PKMPOLBPTPN1
SCHEMBL26661589 0.85 FFAR1 (0.52) FFAR1POLBCISD1MAOAKDM4E
SCHEMBL12417242 0.83 FFAR1 (0.64) FFAR1POLBPTPN1CISD1MAOA
SCHEMBL863491 0.83 FFAR1 (0.48) FFAR1PKMPOLBCISD1MAOA
SCHEMBL9920145 0.82 FFAR1 (0.53) FFAR1PKMPOLBCISD1MAOA
SCHEMBL7858386 0.79 ALDH1A1 (0.53) POLBMAPTLMNATHRB
SCHEMBL1903789 0.79 MMP3 (0.55) POLBPTPN1KDM4EMAPT

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-11820764-B2 Compound modulating GSK-3 activity NATIONAL INSTITUTE OF IMMUNOLOGY (IN) 2023-11-21 — — US disclosed
US-11820764-B2 Compound modulating GSK-3 activity NATIONAL INSTITUTE OF IMMUNOLOGY (IN) 2023-11-21 — — 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-11820764-B2 Compound modulating GSK-3 activity GSK3B, GSK3A, GSKIP FFAR1 3450/4885DUSP3 94/4885DNMT1 3730/4885

“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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