SCHEMBL23710521

SCHEMBL23710521

CO[C@H](CO)[C@@H](O[PH](=O)O)[C@@H](Cl)n1cnc2c(NC(=O)c3ccccc3)ncnc21

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CCNB2 O95067 2/20 0.36
▸ CDK1 P06493 2/20 0.36
▸ CCNB1 P14635 2/20 0.36
▸ CCNB3 Q8WWL7 2/20 0.36
▸ CDK2 P24941 1/20 0.36
▸ FLT4 P35916 1/20 0.35
▸ KDR P35968 1/20 0.35
▸ PRMT6 Q96LA8 1/20 0.35
▸ CDK5 Q00535 2/20 0.34
▸ CDK5R1 Q15078 2/20 0.34
▸ ADORA1 P30542 2/20 0.34
▸ ADORA3 P0DMS8 1/20 0.34
▸ ADORA2A P29274 1/20 0.34
▸ P2RY12 Q9H244 1/20 0.34
▸ HDAC1 Q13547 1/20 0.33
▸ HDAC6 Q9UBN7 1/20 0.33
▸ PDE4A P27815 1/20 0.33
▸ PDE4B Q07343 1/20 0.33
▸ PDE4C Q08493 1/20 0.33
▸ PDE4D Q08499 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
SCHEMBL23710507 0.90 CCNB2 (0.36) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL23046742 0.86 CCNB2 (0.39) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL24722333 0.81 CCNB2 (0.41) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20857311 0.79 CCNB2 (0.39) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL25605575 0.78 CCNB2 (0.39) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL25605574 0.78 CCNB2 (0.38) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL2718523 0.73 CDK1 (0.59) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20052009 0.73 CCNB2 (0.44) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL13896532 0.73 AHCY (0.40) CCNB2CDK1CCNB1CCNB3CDK2
SCHEMBL20052944 0.73 AHCY (0.43) CCNB2CDK1CCNB1CCNB3CDK2

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-20210236531-A1 CYCLIC DINUCLEOTIDES AS AGONISTS OF STIMULATOR OF INTERFERON GENE DEPENDENT SIGNALLING BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2021-08-05 — — 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-20210236531-A1 CYCLIC DINUCLEOTIDES AS AGONISTS OF STIMULATOR OF INTERFERON GENE DEPENDENT SIGNALLING STING1, IRF3, CGAS CCNB2 4359/4885CDK1 3609/4885CCNB1 4419/4885

“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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