SCHEMBL30406830

SCHEMBL30406830

c1cnc2cc(-c3c[nH]c4nc(NC5CCC6(CC5)COC6)ncc34)ccc2n1

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ BRD4 O60885 2/20 0.41
▸ DYRK1A Q13627 5/20 0.39
▸ DYRK1B Q9Y463 2/20 0.39
▸ CLK2 P49760 2/20 0.38
▸ CLK3 P49761 1/20 0.38
▸ RET P07949 3/20 0.37
▸ CDK7 P50613 4/20 0.35
▸ CDC7 O00311 3/20 0.35
▸ PIM1 P11309 3/20 0.35
▸ JAK2 O60674 2/20 0.35
▸ MAP4K4 O95819 2/20 0.35
▸ PRKACA P17612 2/20 0.35
▸ FLT3 P36888 2/20 0.35
▸ GSK3B P49841 2/20 0.35
▸ JAK3 P52333 2/20 0.35
▸ HIPK2 Q9H2X6 2/20 0.35
▸ ADORA2A P29274 2/20 0.35
▸ ADORA1 P30542 2/20 0.35
▸ CDK2 P24941 2/20 0.35
▸ CDK9 P50750 2/20 0.35

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
SCHEMBL25522662 1.00 BRD4 (0.41) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL25519916 0.87 BRD4 (0.41) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL30346467 0.87 BRD4 (0.41) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL30348631 0.87 DYRK1A (0.38) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL25522540 0.87 DYRK1A (0.38) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL25157004 0.87 DYRK1A (0.51) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL30348752 0.87 DYRK1A (0.51) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL25157464 0.87 BRD4 (0.41) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL30407345 0.87 DYRK1A (0.41) BRD4DYRK1ADYRK1BCLK2CLK3
SCHEMBL30406605 0.87 BRD4 (0.41) BRD4DYRK1ADYRK1BCLK2CLK3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — US claimed

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 BRD4 1417/4885DYRK1A 1/4885DYRK1B 2/4885

“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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