SCHEMBL5555028

SCHEMBL5555028

CC(C)(C)OC(=O)c1cc2c(F)cncc2s1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CSNK1D P48730 5/20 0.48
GSK3A P49840 5/20 0.48
GSK3B P49841 5/20 0.48
DYRK1A Q13627 5/20 0.48
AURKB Q96GD4 4/20 0.48
RPS6KB1 P23443 2/20 0.48
NTRK2 Q16620 1/20 0.48
CCNC P24863 5/20 0.46
CDK8 P49336 5/20 0.46
ICAM1 P05362 12/20 0.46
SELE P16581 12/20 0.46
VCAM1 P19320 5/20 0.46
CDK1 P06493 4/20 0.43
PIM1 P11309 4/20 0.43
CDK2 P24941 4/20 0.43
KDR P35968 4/20 0.43
PLK1 P53350 4/20 0.43
PLK3 Q9H4B4 4/20 0.43
PRKACA P17612 3/20 0.43
CDK5 Q00535 3/20 0.43

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
SCHEMBL660155 0.85 CSNK1D (0.63) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL30744198 0.85 CSNK1D (0.63) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL7159801 0.84 ICAM1 (0.62) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL29069419 0.83 ICAM1 (0.43) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL30980406 0.83 ICAM1 (0.43) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL7059753 0.82 ICAM1 (0.44) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL7057688 0.82 CCNC (0.44) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL7051775 0.79 ICAM1 (0.50) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL660382 0.78 GSK3A (0.60) CSNK1DGSK3AGSK3BDYRK1AAURKB
SCHEMBL29069393 0.76 ICAM1 (0.69) CSNK1DGSK3AGSK3BDYRK1AAURKB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1753428-A2 KINASE INHIBITORS AS THERAPEUTIC AGENTS Abbott Laboratories (US) 2007-02-21 EP disclosed
US-20060074102-A1 Kinase inhibitors as therapeutic agents ABBOTT LABORATORIES 2006-04-06 US disclosed
WO-2005110410-A2 KINASE INHIBITORS AS THERAPEUTIC AGENTS ABBOTT LABORATORIES (US) 2005-11-24 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-20060074102-A1 Kinase inhibitors as therapeutic agents ABL1, MAP3K19, MAP3K20 CSNK1D 151/4885GSK3A 453/4885GSK3B 462/4885

“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.