SCHEMBL30813452

SCHEMBL30813452

CC(C)(C)OC(=O)N(C(=O)OC(C)(C)C)c1ncnc2c1c(I)cn2C1CC1

nearest known ligand 0.39

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 13/20 0.39
▸ EGFR P00533 3/20 0.39
▸ RIPK2 O43353 3/20 0.36
▸ ABL1 P00519 2/20 0.36
▸ ABL2 P42684 2/20 0.36
▸ ADK P55263 1/20 0.33
▸ PDPK1 O15530 1/20 0.33
▸ HASPIN Q8TF76 1/20 0.33
▸ MTOR P42345 1/20 0.33
▸ RAB9A P51151 1/20 0.33

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
SCHEMBL30813365 0.96 SRC (0.38) SRCEGFRABL1ABL2
SCHEMBL27217948 0.95 SRC (0.39) SRCEGFRRIPK2ABL1ABL2
SCHEMBL30813374 0.91 SRC (0.49) SRCEGFRABL1ABL2
SCHEMBL27217725 0.91 SRC (0.49) SRCEGFRABL1ABL2
SCHEMBL27217916 0.91 SRC (0.38) SRCEGFRABL1ABL2
SCHEMBL30813522 0.90 SRC (0.35) SRCEGFRABL1ABL2ADK
SCHEMBL30813708 0.89 SRC (0.38) SRCEGFRABL1ABL2
SCHEMBL30813751 0.89 SRC (0.43) SRCEGFRABL1ABL2
SCHEMBL20692747 0.87 SRC (0.39) SRCEGFRRIPK2ABL1ABL2
SCHEMBL27217707 0.86 SRC (0.36) SRCEGFRABL1ABL2ADK

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240158394-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. 2024-05-16 — — US disclosed
WO-2024059200-A1 NEK7 INHIBITORS Halia Therapeutics, Inc. (US) 2024-03-21 — — WO 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-20240158394-A1 NEK7 INHIBITORS NEK7, NEK5, NEK1 SRC 1597/4885EGFR 4857/4885RIPK2 45/4885

“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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