SCHEMBL23036906

SCHEMBL23036906

O=C1NC(=S)S/C1=C\c1cnn(-c2ccccc2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 13/20 1.00
▸ RPTOR Q8N122 5/20 1.00
▸ MLST8 Q9BVC4 5/20 1.00
▸ NAT1 P18440 2/20 0.62
▸ CA2 P00918 1/20 0.62
▸ EPHX1 P07099 1/20 0.62
▸ PTGS2 P35354 1/20 0.58
▸ MMP3 P08254 1/20 0.53
▸ MMP13 P45452 1/20 0.53
▸ MAOA P21397 1/20 0.52
▸ CISD1 Q9NZ45 1/20 0.52

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
SCHEMBL23036936 0.88 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036892 0.88 MTOR (1.00) MTORRPTORMLST8NAT1PTGS2
SCHEMBL23036907 0.88 MTOR (1.00) MTORRPTORMLST8NAT1MAOA
SCHEMBL23036888 0.88 MTOR (0.79) MTORRPTORMLST8NAT1PTGS2
SCHEMBL23036886 0.87 MTOR (0.78) MTORRPTORMLST8NAT1
SCHEMBL23036919 0.87 MTOR (1.00) MTORRPTORMLST8PTGS2
SCHEMBL23036924 0.86 MTOR (0.76) MTORRPTORMLST8NAT1CA2
SCHEMBL30438525 0.86 MTOR (0.76) MTORRPTORMLST8NAT1CA2
SCHEMBL23036914 0.86 MTOR (1.00) MTORRPTORMLST8NAT1CISD1
SCHEMBL23036913 0.85 MTOR (1.00) MTORRPTORMLST8NAT1PTGS2

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 11 patents. 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 claimed
US-20210292314-A1 NOVEL COMPOUND AS mTOR INHIBITOR AND USE THEREOF MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2021-09-23 — — US claimed
EP-3786163-A1 NOVEL COMPOUND AS MTOR INHIBITOR AND USE THEREOF Medicinal Bioconvergence Research Center (KR) 2021-03-03 — — EP claimed
CN-112368279-A Novel compounds as mTOR inhibitors and uses thereof 医药生命融合研究团 2021-02-12 — — CN claimed
US-11649231-B2 Compound as mTOR inhibitor and use thereof MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2023-05-16 — — US disclosed
US-11649231-B2 Compound as mTOR inhibitor and use thereof MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2023-05-16 — — US disclosed
US-11649231-B2 Compound as mTOR inhibitor and use thereof MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2023-05-16 — — US disclosed
US-20210292314-A1 NOVEL COMPOUND AS mTOR INHIBITOR AND USE THEREOF MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2021-09-23 — — US disclosed
US-20210292314-A1 NOVEL COMPOUND AS mTOR INHIBITOR AND USE THEREOF MEDICINAL BIOCONVERGENCE RESEARCH CENTER (KR) 2021-09-23 — — US disclosed
EP-3786163-A1 NOVEL COMPOUND AS MTOR INHIBITOR AND USE THEREOF Medicinal Bioconvergence Research Center (KR) 2021-03-03 — — EP disclosed
CN-112368279-A Novel compounds as mTOR inhibitors and uses thereof 医药生命融合研究团 2021-02-12 — — CN 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 (2 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
US-20210292314-A1 NOVEL 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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