SCHEMBL6877663

SCHEMBL6877663

CC(=O)O[C@@H]1[C@H](OC(C)=O)[C@@H](C)O[C@H]1n1c(Br)c(C#N)c2c(N)ncnc21

nearest known ligand 0.50

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ DYRK1A Q13627 1/20 0.50
▸ CDK5 Q00535 1/20 0.43
▸ CDK5R1 Q15078 1/20 0.43
▸ CCNA2 P20248 4/20 0.42
▸ CDK2 P24941 4/20 0.42
▸ CCNA1 P78396 4/20 0.42
▸ ADK P55263 5/20 0.42
▸ HSPA8 P11142 2/20 0.42
▸ LRRK2 Q5S007 7/20 0.41
▸ CDK1 P06493 1/20 0.39
▸ CCNB1 P14635 1/20 0.39

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
SCHEMBL1737251 0.80 ABL1 (0.42) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL6738031 0.80 ABL1 (0.42) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL6868829 0.72 P2RX3 (0.38) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL6873394 0.72 P2RX3 (0.39) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL6873391 0.72 P2RX3 (0.39) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL6873374 0.71 P2RX3 (0.38) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL6868826 0.70 P2RX3 (0.39) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL30582621 0.69 DYRK1A (1.00) DYRK1ACDK5CDK5R1CCNA2CDK2
SCHEMBL15233798 0.66 CDK1 (0.74) CCNA2CDK2CCNA1ADKHSPA8
SCHEMBL13064460 0.66 ADK (0.54) ADK

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-6831069-B2 Having substituents at the C4' and C5' positions of the ribofuranose moiety; anticancer and immunomodulating effects at reduced cytotoxicity; treating autoimmune diseases, cancer, dermatitis RIBAPHARM INC. 2004-12-14 — — US disclosed
US-20020035077-A1 Pyrrolo[2,3-d]pyrimidine nucleoside analogs CEQUENT PHARMACEUTICALS, INC. 2002-03-21 — — 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 (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-20020035077-A1 Pyrrolo[2,3-d]pyrimidine nucleoside analogs TYMP, DPYD, TYMS DYRK1A 3331/4885CDK5 478/4885CDK5R1 789/4885

“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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