SCHEMBL23779238

SCHEMBL23779238

COc1c(Nc2cc(NC(=O)C3CC3)nnc2C)cccc1-c1ncn(C)n1

nearest known ligand 0.82

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ TYK2 P29597 19/20 0.82
▸ JAK2 O60674 3/20 0.79
▸ JAK1 P23458 3/20 0.76
▸ STAT3 P40763 1/20 0.76
▸ STAT1 P42224 1/20 0.76
▸ JAK3 P52333 1/20 0.76
▸ BMPR2 Q13873 1/20 0.76

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
SCHEMBL30968156 1.00 TYK2 (0.82) TYK2JAK2JAK1STAT3STAT1
SCHEMBL26041930 0.91 TYK2 (0.82) TYK2JAK2JAK1STAT3STAT1
SCHEMBL22647341 0.90 TYK2 (1.00) TYK2JAK2JAK1STAT3STAT1
SCHEMBL31369028 0.90 TYK2 (0.87) TYK2JAK2JAK1STAT3STAT1
SCHEMBL30065968 0.90 TYK2 (0.81) TYK2JAK2JAK1STAT3STAT1
SCHEMBL23096153 0.90 TYK2 (0.87) TYK2JAK2JAK1STAT3STAT1
SCHEMBL22647338 0.90 TYK2 (0.87) TYK2JAK2JAK1STAT3STAT1
SCHEMBL22263494 0.90 TYK2 (0.87) TYK2JAK2JAK1STAT3STAT1
SCHEMBL22313877 0.90 TYK2 (0.81) TYK2JAK2JAK1STAT3STAT1
SCHEMBL32691810 0.90 TYK2 (0.87) TYK2JAK2JAK1STAT3STAT1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113227071-B Amide-substituted heterocyclic compounds for the treatment of disorders associated with modulation of IL-12, IL-23 and/or IFN-alpha 百时美施贵宝公司 2024-06-25 — — CN disclosed
US-20230020273-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CONDITIONS RELATED TO THE MODULATION OF IL-12, IL-23 AND/OR IFN-ALPHA BRISTOL MYERS SQUIBB CO (US) 2023-01-19 — — US disclosed
EP-3873892-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CONDITIONS RELATED TO THE MODULATION OF IL-12, IL-23 AND/OR IFN-ALPHA Bristol-Myers Squibb Company (US) 2021-09-08 — — EP disclosed
CN-113227071-A Amide-substituted heterocyclic compounds for the treatment of disorders associated with the modulation of IL-12, IL-23 and/or IFN-alpha 百时美施贵宝公司 2021-08-06 — — 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 (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-20230020273-A1 AMIDE-SUBSTITUTED HETEROCYCLIC COMPOUNDS FOR THE TREATMENT OF CONDITIONS RELATED TO THE MODULATION OF IL-12, IL-23 AND/OR IFN-ALPHA TYK2, IFNG, JAK3 TYK2 1/4885JAK2 7/4885JAK1 5/4885

“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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