SCHEMBL13637139

SCHEMBL13637139

CN1CCNC(=O)C(C)(C)C1

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NPSR1 Q6W5P4 1/20 0.33
OTUD7B Q6GQQ9 1/20 0.33
TOP2A P11388 1/20 0.31
TOP2B Q02880 1/20 0.31
GRIN1 Q05586 1/20 0.30
GRIN2A Q12879 1/20 0.30
GRIN2B Q13224 1/20 0.30

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
SCHEMBL13625472 0.75 TOP2A (0.42) OTUD7BTOP2ATOP2B
SCHEMBL1126303 0.70 TOP2A (0.32) NPSR1OTUD7BTOP2ATOP2B
SCHEMBL19851165 0.69 OTUD7B (0.36) OTUD7BGRIN1GRIN2AGRIN2B
SCHEMBL21150733 0.68 NPSR1 (0.33) NPSR1
SCHEMBL20414626 0.68 OTUD7B (0.57) OTUD7BGRIN1GRIN2AGRIN2B
SCHEMBL22172615 0.68 OTUD7B (0.57) OTUD7BGRIN1GRIN2AGRIN2B
SCHEMBL13879320 0.68 OTUD7B (0.57) OTUD7BGRIN1GRIN2AGRIN2B
SCHEMBL247639 0.67
SCHEMBL6806461 0.67 RAB9A (0.31)
SCHEMBL19851182 0.67 NEK2 (0.30)

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-7612200-B2 Inhibitors of protein kinases LOCUS PHARMACEUTICALS, INC. (US) 2009-11-03 US disclosed
US-20090192307-A1 INHIBITORS OF PROTEIN KINASES LOCUS PHARMACEUTICALS, INC. 2009-07-30 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-20090192307-A1 INHIBITORS OF PROTEIN KINASES MAP3K20, MAP3K1, MAP3K19 NPSR1 2761/4885OTUD7B 2216/4885TOP2A 3013/4885

“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.