SCHEMBL13935936

SCHEMBL13935936

O=C1NC(=S)S/C1=C\c1ccccc1OCCc1cccs1

nearest known ligand 0.69

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
▸ GSK3B P49841 1/20 0.69
▸ NAT1 P18440 3/20 0.60
▸ PTP4A3 O75365 4/20 0.59
▸ HPGD P15428 4/20 0.56
▸ ADAMTS5 Q9UNA0 1/20 0.56
▸ PIM1 P11309 4/20 0.54
▸ PDE4B Q07343 1/20 0.51
▸ PPARG P37231 1/20 0.50

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
SCHEMBL10090184 0.87 PTP4A3 (0.65) GSK3BPTP4A3HPGDADAMTS5PIM1
SCHEMBL2064983 0.87 PTP4A3 (0.65) GSK3BPTP4A3HPGDADAMTS5PIM1
SCHEMBL2064984 0.87 PTP4A3 (0.65) GSK3BPTP4A3HPGDADAMTS5PIM1
SCHEMBL18102857 0.80 GSK3B (0.77) GSK3BNAT1PTP4A3PIM1PDE4B
SCHEMBL18102849 0.79 GSK3B (0.75) GSK3BNAT1PTP4A3PIM1PDE4B
SCHEMBL19999112 0.79 NAT1 (0.81) GSK3BNAT1PTP4A3PIM1PDE4B
SCHEMBL18103046 0.78 GSK3B (0.73) GSK3BNAT1PTP4A3PIM1PDE4B
SCHEMBL18102860 0.78 GSK3B (0.73) GSK3BNAT1PTP4A3PIM1PDE4B
SCHEMBL2064980 0.78 PTP4A3 (0.83) GSK3BNAT1PTP4A3HPGDADAMTS5
SCHEMBL10090211 0.78 PTP4A3 (0.83) GSK3BNAT1PTP4A3HPGDADAMTS5

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-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2009-02-12 — — US disclosed
US-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same KOREA RESEARCH INSTITUTE OF BIOSCIENCE AND BIOTECHNOLOGY (KR) 2009-02-12 — — 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-20090042872-A1 Rhodanine Derivatives, a Process for the Preparation Thereof and Pharmaceutical Composition Containing the Same PTPRR, PTPRG, PTPRS GSK3B 390/4885NAT1 4105/4885PTP4A3 28/4885

“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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