SCHEMBL20262443

SCHEMBL20262443

Cn1cc(NC(=O)OC(C)(C)C)c(I)n1

nearest known ligand 0.41

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 1/20 0.41
▸ BRD9 Q9H8M2 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ DYRK1A Q13627 1/20 0.39
▸ CNR2 P34972 1/20 0.37
▸ ATR Q13535 1/20 0.37
▸ PTGDR2 Q9Y5Y4 1/20 0.36
▸ MAPK14 Q16539 1/20 0.36
▸ METAP1 P53582 1/20 0.36
▸ LMNA P02545 2/20 0.35
▸ KDM4E B2RXH2 1/20 0.35
▸ ADORA3 P0DMS8 1/20 0.35
▸ ADORA2A P29274 1/20 0.35
▸ ADORA1 P30542 1/20 0.35
▸ CYP17A1 P05093 1/20 0.35
▸ IDO1 P14902 1/20 0.34
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34

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
SCHEMBL20276702 0.83 LMNA (0.47) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL31437491 0.82 LMNA (0.40) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL22857998 0.81 IRAK4 (0.45) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL27457955 0.79 ATR (0.39) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL22857997 0.79 CNR2 (0.53) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL27457954 0.79 GSK3B (0.40) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL18215077 0.79 ALOX5 (0.42) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL31439890 0.78 GSK3B (0.39) IRAK4BRD9GSK3BDYRK1ACNR2
SCHEMBL31555029 0.78 IRAK4 (0.41) IRAK4
SCHEMBL18138349 0.77 L3MBTL1 (0.39) IRAK4BRD9GSK3BDYRK1ACNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4095138-A1 INHIBITORS OF RIP1 KINASE AND METHODS OF USE THEREOF F. Hoffmann-La Roche AG (CH) 2022-11-30 — — EP disclosed
EP-3555093-B1 INHIBITORS OF RIP1 KINASE AND METHODS OF USE THEREOF HOFFMANN LA ROCHE (CH) 2022-09-21 — — EP disclosed
CN-110072863-B RIP1 kinase inhibitors and methods of use 豪夫迈·罗氏有限公司 2022-08-30 — — CN disclosed
US-11072607-B2 Inhibitors of RIP1 kinase and methods of use thereof GENENTECH, INC. (US) 2021-07-27 — — US disclosed
US-11072607-B2 Inhibitors of RIP1 kinase and methods of use thereof GENENTECH, INC. (US) 2021-07-27 — — US disclosed
US-20180170927-A1 INHIBITORS OF RIP1 KINASE AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-06-21 — — US disclosed
US-20180170927-A1 INHIBITORS OF RIP1 KINASE AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2018-06-21 — — 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 (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-11072607-B2 Inhibitors of RIP1 kinase and methods of use thereof RIPK1, RIPK2, RIPK4 IRAK4 49/4885BRD9 1531/4885GSK3B 365/4885
US-20180170927-A1 INHIBITORS OF RIP1 KINASE AND METHODS OF USE THEREOF RIPK1, RIPK2, RIPK4 IRAK4 49/4885BRD9 1531/4885GSK3B 365/4885

“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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