SCHEMBL30813511

SCHEMBL30813511

CN1CCC(n2cc(B3OC(C)(C)C(C)(C)O3)c3c(N(C(=O)OC(C)(C)C)C(=O)OC(C)(C)C)ncnc32)C1

nearest known ligand 0.39

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
▸ SRC P12931 12/20 0.39
▸ EGFR P00533 3/20 0.39
▸ ABL1 P00519 2/20 0.36
▸ ABL2 P42684 2/20 0.36
▸ USP30 Q70CQ3 2/20 0.35
▸ BACE1 P56817 1/20 0.33
▸ BACE2 Q9Y5Z0 1/20 0.33
▸ FGFR1 P11362 1/20 0.33
▸ FGFR2 P21802 1/20 0.33
▸ FGFR4 P22455 1/20 0.33
▸ FGFR3 P22607 1/20 0.33
▸ NEK7 Q8TDX7 1/20 0.33
▸ PIK3CD O00329 2/20 0.32
▸ HTR6 P50406 1/20 0.31

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
SCHEMBL27218001 0.96 SRC (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL21221307 0.90 USP30 (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL30813401 0.89 USP30 (0.38) SRCEGFRABL1ABL2USP30
SCHEMBL27218035 0.88 SRC (0.44) SRCEGFRABL1ABL2USP30
SCHEMBL30813371 0.88 SRC (0.44) SRCEGFRABL1ABL2USP30
SCHEMBL30813509 0.87 USP30 (0.39) SRCEGFRABL1ABL2USP30
SCHEMBL30813501 0.87 USP30 (0.36) SRCEGFRABL1ABL2USP30
SCHEMBL27217761 0.85 USP30 (0.36) SRCEGFRABL1ABL2USP30
SCHEMBL27217808 0.83 SRC (0.35) SRCEGFRABL1ABL2USP30
SCHEMBL27217649 0.83 USP30 (0.38) SRCEGFRUSP30BACE1BACE2

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 4857/4885ABL1 3937/4885

“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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