SCHEMBL13333277

SCHEMBL13333277

CC(C)(C)OC(=O)NCCCCNC(=O)c1cccn(Cc2cccc(Cl)c2)c1=O

nearest known ligand 0.64

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
▸ PDPK1 O15530 7/20 0.61
▸ MAPT P10636 2/20 0.58
▸ POLB P06746 1/20 0.58
▸ KMT2A Q03164 2/20 0.57
▸ MEN1 O00255 1/20 0.57
▸ TP53 P04637 1/20 0.56
▸ RXFP1 Q9HBX9 1/20 0.55
▸ KDM4E B2RXH2 3/20 0.53
▸ SMN1; SMN2 Q16637 3/20 0.52
▸ ALDH1A1 P00352 2/20 0.52
▸ BRD4 O60885 1/20 0.52
▸ EGLN1 Q9GZT9 1/20 0.49

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
SCHEMBL13306397 0.99 PDPK1 (0.62) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL13306405 0.93 PDPK1 (0.64) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL14309044 0.93 PDPK1 (0.64) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL4989827 0.88 MAPT (0.50) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL14090925 0.87 MAPT (0.51) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL15871894 0.84 PDPK1 (0.67) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL13306400 0.83 PDPK1 (0.63) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL4430752 0.81 C3AR1 (0.46) PDPK1MAPTPOLBKMT2AMEN1
SCHEMBL4989511 0.80 BRD4 (0.53) MAPTPOLBKMT2AMEN1RXFP1
SCHEMBL4989359 0.79 BRD4 (0.54) MAPTPOLBKMT2AMEN1TP53

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-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS SUNESIS PHAMACEUTICALS (US) 2010-06-10 — — 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-20100144730-A1 PYRIDINONYL PDK1 INHIBITORS PDK1, PDK2, PDK3 PDPK1 5/4885MAPT 3341/4885POLB 2784/4885

“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.

Send feedback