SCHEMBL3489007

SCHEMBL3489007

CC(C)(C)OC(=O)NC1CCN(C2CCN(CC3CC3)CC2)CC1

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 9/20 0.55
CTSK P43235 2/20 0.46
KCNA3 P22001 1/20 0.46
OPRM1 P35372 1/20 0.45
OPRD1 P41143 1/20 0.45
OPRK1 P41145 1/20 0.45
OGFRL1 Q5TC84 1/20 0.45
JAK2 O60674 2/20 0.44
JAK1 P23458 2/20 0.44
DRD3 P35462 1/20 0.43
BTK Q06187 1/20 0.40
CA1 P00915 1/20 0.40
CA2 P00918 1/20 0.40
CYP2C9 P11712 1/20 0.40
HSD11B1 P28845 1/20 0.40
KMT2A Q03164 1/20 0.40
L3MBTL1 Q9Y468 1/20 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
SCHEMBL2483799 0.92 DRD2 (0.61) DRD2CTSKKCNA3JAK2JAK1
SCHEMBL3488494 0.90 DRD2 (0.52) DRD2CTSKKCNA3JAK2JAK1
SCHEMBL3488727 0.87 CTSK (0.48) DRD2CTSKKCNA3OPRM1OPRD1
SCHEMBL8187882 0.85 DRD2 (0.55) DRD2CTSKKCNA3BTKCA1
SCHEMBL1604214 0.85 DRD2 (0.55) DRD2CTSKKCNA3BTKCA1
SCHEMBL3370047 0.85 CTSK (0.56) DRD2CTSKKCNA3OPRM1OPRD1
SCHEMBL14651348 0.84 DRD2 (0.62) DRD2CTSKKCNA3JAK2JAK1
SCHEMBL12501447 0.84 DRD2 (0.62) DRD2CTSKKCNA3JAK2JAK1
SCHEMBL3489553 0.84 CTSK (0.45) DRD2CTSKKCNA3OPRM1OPRD1
SCHEMBL6582240 0.83 DRD2 (0.53) DRD2CTSKKCNA3JAK2JAK1

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-20100075973-A1 POLO-LIKE KINASE INHIBITORS TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) 2010-03-25 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-20100075973-A1 POLO-LIKE KINASE INHIBITORS PLK2, PLK4, PLK1 DRD2 4823/4885CTSK 394/4885KCNA3 3391/4885

“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.