SCHEMBL25519871

SCHEMBL25519871

FC1(F)CCC(CNc2ncc3c(-c4ccc5ncccc5c4)c[nH]c3n2)CC1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 8/20 0.49
▸ CLK2 P49760 2/20 0.49
▸ CLK3 P49761 2/20 0.49
▸ CLK1 P49759 2/20 0.44
▸ CLK4 Q9HAZ1 1/20 0.44
▸ CDC7 O00311 1/20 0.42
▸ ROCK2 O75116 1/20 0.42
▸ CCNB2 O95067 1/20 0.42
▸ MAP4K4 O95819 1/20 0.42
▸ CDK1 P06493 1/20 0.42
▸ RET P07949 1/20 0.42
▸ CCNB1 P14635 1/20 0.42
▸ PRKACA P17612 1/20 0.42
▸ CDK2 P24941 1/20 0.42
▸ GSK3B P49841 1/20 0.42
▸ CCNB3 Q8WWL7 1/20 0.42
▸ HIPK2 Q9H2X6 1/20 0.42
▸ MKNK2 Q9HBH9 1/20 0.42
▸ IRAK4 Q9NWZ3 1/20 0.42
▸ BRD4 O60885 2/20 0.40

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
SCHEMBL30407829 1.00 DYRK1A (0.49) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25157286 0.90 DYRK1A (0.40) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30346905 0.90 DYRK1A (0.40) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25157439 0.88 TDO2 (0.45) DYRK1ACLK2CLK3CDC7ROCK2
SCHEMBL30346470 0.86 DYRK1A (0.51) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25157796 0.86 DYRK1A (0.51) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25201500 0.86 DYRK1A (0.62) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30348925 0.86 DYRK1A (0.62) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL25212368 0.84 DYRK1A (0.53) DYRK1ACLK2CLK3CLK1CLK4
SCHEMBL30407028 0.84 DYRK1A (0.53) DYRK1ACLK2CLK3CLK1CLK4

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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF VICKERS VENTURE FUND VI PTE. LTD. (SG) 2023-06-01 — — US disclosed
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 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-20230167133-A1 7H-PYRROLO[2,3-D]PYRIMIDINES AND PREPARATION AND USES THEREOF DYRK1A, DYRK1B, DYRK2 DYRK1A 1/4885CLK2 466/4885CLK3 1147/4885

“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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