SCHEMBL3597844

SCHEMBL3597844

O=S(=O)(c1ccc(Nc2nc(Nc3ccc(OCCO)nc3)nc3c2ncn3-c2cccc(F)c2)cc1)C1CCOCC1

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 13/20 0.41
CSNK1E P49674 8/20 0.41
BTK Q06187 3/20 0.40
ABL1 P00519 2/20 0.40
SYK P43405 2/20 0.37
AXL P30530 1/20 0.36
FLT3 P36888 1/20 0.36
TYRO3 Q06418 1/20 0.36
MERTK Q12866 1/20 0.36

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
SCHEMBL3592810 0.78 CDK1 (0.44) CSNK1DCSNK1EBTKABL1FLT3
SCHEMBL3587372 0.69 CSNK1D (0.41) CSNK1DCSNK1EBTKABL1
SCHEMBL3595696 0.68 CDK1 (0.59) FLT3
SCHEMBL3586487 0.68 ABL1 (0.39) CSNK1DCSNK1EBTKABL1
SCHEMBL3588335 0.67 BTK (0.48) CSNK1DCSNK1EBTKABL1AXL
SCHEMBL3585124 0.67 CDK1 (0.48) CSNK1DCSNK1EBTKABL1
SCHEMBL4439037 0.66 CSNK1D (0.43) CSNK1DCSNK1EBTKABL1
SCHEMBL3601333 0.65 AURKA (0.39) CSNK1DCSNK1EBTK
SCHEMBL3600080 0.63 CSNK1D (0.41) CSNK1DCSNK1EBTKABL1
SCHEMBL3593099 0.63 CSNK1D (0.44) CSNK1DCSNK1EBTKABL1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2010-03-04 US claimed
EP-2124954-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2009-12-02 EP claimed
WO-2008094737-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2008-08-07 WO claimed
US-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2010-03-04 US disclosed
EP-2124954-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2009-12-02 EP disclosed
WO-2008094737-A2 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES IRM LLC (BM) 2008-08-07 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-20100056494-A1 PURINE COMPOUNDS AND COMPOSITIONS AS KINASE INHIBITORS FOR THE TREATMENT OF PLASMODIUM RELATED DISEASES ADK, PNP, DCK CSNK1D 1542/4885CSNK1E 1264/4885BTK 381/4885

“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.