SCHEMBL30438520

SCHEMBL30438520

O=C1NC(=S)S/C1=C\c1cnn(-c2ccccc2Cl)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 12/20 1.00
▸ RPTOR Q8N122 4/20 0.71
▸ MLST8 Q9BVC4 4/20 0.71
▸ PIM1 P11309 1/20 0.55
▸ NAT1 P18440 4/20 0.53
▸ CA2 P00918 1/20 0.53
▸ EPHX1 P07099 1/20 0.53
▸ MYC P01106 1/20 0.51
▸ MAX P61244 1/20 0.51
▸ DNM1 Q05193 1/20 0.49

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
SCHEMBL23036890 1.00 MTOR (1.00) MTORRPTORMLST8PIM1NAT1
SCHEMBL23036912 0.88 MTOR (0.79) MTORRPTORMLST8PIM1
SCHEMBL30438517 0.88 MTOR (0.79) MTORRPTORMLST8PIM1
SCHEMBL30437715 0.86 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036897 0.86 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036916 0.84 MTOR (1.00) MTORRPTORMLST8NAT1
SCHEMBL30438513 0.84 MTOR (1.00) MTORRPTORMLST8NAT1
SCHEMBL23036906 0.83 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036892 0.81 MTOR (1.00) MTORRPTORMLST8NAT1MYC
SCHEMBL23036886 0.81 MTOR (0.78) MTORRPTORMLST8PIM1NAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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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