SCHEMBL30438517

SCHEMBL30438517

O=C1NC(=O)/C(=C/c2cnn(-c3ccccc3Cl)c2)S1

nearest known ligand 0.79

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 11/20 0.79
▸ RPTOR Q8N122 4/20 0.55
▸ MLST8 Q9BVC4 4/20 0.55
▸ PIM1 P11309 3/20 0.52
▸ PIM2 Q9P1W9 3/20 0.52
▸ PIM3 Q86V86 1/20 0.52
▸ NPC1 O15118 1/20 0.51
▸ HTT P42858 1/20 0.51
▸ RAB9A P51151 1/20 0.51
▸ MGAM O43451 2/20 0.50
▸ GAA P10253 2/20 0.50
▸ SI P14410 2/20 0.50
▸ MGAM2 Q2M2H8 2/20 0.50
▸ IGF1R P08069 1/20 0.50
▸ CISD1 Q9NZ45 1/20 0.48
▸ GSK3B P49841 1/20 0.48

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
SCHEMBL23036912 1.00 MTOR (0.79) MTORRPTORMLST8PIM1PIM2
SCHEMBL23036890 0.88 MTOR (1.00) MTORRPTORMLST8PIM1
SCHEMBL30438520 0.88 MTOR (1.00) MTORRPTORMLST8PIM1
SCHEMBL30438642 0.86 MTOR (0.79) MTORRPTORMLST8PIM1PIM2
SCHEMBL23036904 0.86 MTOR (0.79) MTORRPTORMLST8PIM1PIM2
SCHEMBL23036935 0.83 MTOR (0.80) MTORRPTORMLST8PIM1PIM2
SCHEMBL30438310 0.83 MTOR (0.80) MTORRPTORMLST8PIM1PIM2
SCHEMBL23036919 0.83 MTOR (1.00) MTORRPTORMLST8PIM1PIM2
SCHEMBL23036926 0.81 MTOR (0.78) MTORRPTORMLST8PIM1PIM2
SCHEMBL23036900 0.80 MTOR (0.76) MTORRPTORMLST8PIM1PIM2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-112368279-B Novel compounds as mTOR inhibitors and uses thereof 医药生命融合研究团 2024-05-28 — — CN claimed
CN-112368279-B Novel compounds as mTOR inhibitors and uses thereof 医药生命融合研究团 2024-05-28 — — CN disclosed
US-11649231-B2 Compound as mTOR inhibitor and use thereof MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2023-05-16 — — 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-11649231-B2 Compound as mTOR inhibitor and use thereof MTOR, RICTOR, RPTOR MTOR 1/4885RPTOR 3/4885MLST8 8/4885

“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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