SCHEMBL5373531

SCHEMBL5373531

COc1ccc(NC(C)=O)cc1NC(=O)Nc1cnccn1

nearest known ligand 0.73

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 9/20 0.73
KMT2A Q03164 5/20 0.71
MEN1 O00255 4/20 0.71
POLB P06746 2/20 0.71
CHEK1 O14757 2/20 0.67
RAB9A P51151 6/20 0.56
NPC1 O15118 3/20 0.53
HTT P42858 1/20 0.53
HSD17B10 Q99714 1/20 0.53
SMN1; SMN2 Q16637 2/20 0.52
GAA P10253 1/20 0.52
ATR Q13535 1/20 0.52
IRAK4 Q9NWZ3 1/20 0.50

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
SCHEMBL2034370 0.85 KDM4E (0.69) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL2037000 0.85 KDM4E (0.65) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL5373752 0.84 KDM4E (1.00) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL2035848 0.83 KDM4E (0.76) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL5372209 0.83 KMT2A (1.00) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL2031887 0.82 KDM4E (0.74) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL2031582 0.82 KDM4E (0.74) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL3314663 0.81 KDM4E (0.73) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL5386923 0.81 KDM4E (0.72) KDM4EKMT2AMEN1POLBCHEK1
SCHEMBL5368898 0.81 KDM4E (0.71) KDM4EKMT2AMEN1POLBCHEK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7202244-B2 Chk-1 inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-04-10 US disclosed
US-7202244-B2 Chk-1 inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-04-10 US disclosed
US-7202244-B2 Chk-1 inhibitors MILLENNIUM PHARMACEUTICALS, INC. (US) 2007-04-10 US disclosed
US-20040014765-A1 Chk-1 inhibitors MILLENNIUM PHARMACEUTICALS, INC. 2004-01-22 US disclosed
WO-2003101444-A1 DIARYLUREA COMPOUNDS AND DERIVATIVES AS CHK-1 INHIBITORS FOR THE TREATMENT OF CANCER MILLENNIUM PHARMACEUTICALS, INC. (US) 2003-12-11 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-20040014765-A1 Chk-1 inhibitors CHKA, CHKB, CHEK1 KDM4E 1251/4885KMT2A 1919/4885MEN1 1973/4885

“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.