SCHEMBL23036884

SCHEMBL23036884

O=C1NC(=S)S/C1=C\c1cnn(-c2ccccn2)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MTOR P42345 14/20 1.00
▸ RPTOR Q8N122 5/20 0.71
▸ MLST8 Q9BVC4 5/20 0.71
▸ NAT1 P18440 2/20 0.53
▸ CA2 P00918 1/20 0.53
▸ EPHX1 P07099 1/20 0.53
▸ CISD1 Q9NZ45 2/20 0.51
▸ MAOA P21397 1/20 0.51
▸ PIK3CD O00329 1/20 0.50
▸ PIM1 P11309 1/20 0.50
▸ CSNK2A2 P19784 1/20 0.50
▸ PIK3CA P42336 1/20 0.50
▸ PIK3CG P48736 1/20 0.50
▸ CLK1 P49759 1/20 0.50
▸ CLK3 P49761 1/20 0.50
▸ CSNK2B P67870 1/20 0.50
▸ CSNK2A1 P68400 1/20 0.50
▸ DYRK1A Q13627 1/20 0.50
▸ HASPIN Q8TF76 1/20 0.50
▸ DYRK2 Q92630 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
SCHEMBL23036906 0.83 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL30438520 0.80 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL30437715 0.80 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036890 0.80 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036936 0.80 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036897 0.80 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036920 0.78 MTOR (1.00) MTORRPTORMLST8NAT1CA2
SCHEMBL23036924 0.78 MTOR (0.76) MTORRPTORMLST8NAT1CA2
SCHEMBL30438525 0.78 MTOR (0.76) MTORRPTORMLST8NAT1CA2
SCHEMBL29249418 0.77 MTOR (0.63) MTORRPTORMLST8

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 13 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
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
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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