SCHEMBL5501880

SCHEMBL5501880

CCOc1cc(NC(C)=O)nc2ccc(C=C3SC(N)=NC3=O)cc12

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KMT2A Q03164 15/20 0.59
MEN1 O00255 13/20 0.59
GAA P10253 1/20 0.59
CHEK1 O14757 1/20 0.49
DAPK3 O43293 1/20 0.49
PRKD3 O94806 1/20 0.49
PIM1 P11309 1/20 0.49
MAPK8 P45983 1/20 0.49
CSNK1A1 P48729 1/20 0.49
CDK8 P49336 1/20 0.49
CLK2 P49760 1/20 0.49
CDK9 P50750 1/20 0.49
CDK5 Q00535 1/20 0.49
DYRK1A Q13627 1/20 0.49
LRRK2 Q5S007 1/20 0.49
CLK4 Q9HAZ1 1/20 0.49
DYRK1B Q9Y463 1/20 0.49
POLB P06746 5/20 0.48
PTPN22 Q9Y2R2 1/20 0.47
MAPT P10636 6/20 0.47

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
SCHEMBL14452283 1.00 KMT2A (0.59) KMT2AMEN1GAACHEK1DAPK3
SCHEMBL5501876 1.00 KMT2A (0.59) KMT2AMEN1GAACHEK1DAPK3
SCHEMBL14452278 0.85 CISD1 (0.42) KMT2AMEN1GAAPIM1POLB
SCHEMBL5503965 0.85 CISD1 (0.42) KMT2AMEN1GAAPIM1POLB
SCHEMBL5503961 0.85 CISD1 (0.42) KMT2AMEN1GAAPIM1POLB
SCHEMBL5503371 0.85 KMT2A (0.65) KMT2AMEN1GAACHEK1DAPK3
SCHEMBL14452272 0.85 KMT2A (0.65) KMT2AMEN1GAACHEK1DAPK3
SCHEMBL5503375 0.85 KMT2A (0.65) KMT2AMEN1GAACHEK1DAPK3
SCHEMBL5502873 0.83 CISD1 (0.41) KMT2AMEN1GAAPIM1POLB
SCHEMBL14452289 0.83 CISD1 (0.41) KMT2AMEN1GAAPIM1POLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7241893-B2 Thiazolinone 2-substituted quinolines HOFFMAN-LA ROCHE INC. (US) 2007-07-10 US claimed
EP-1791836-A1 THIAZOLINONE 2-SUBSTITUTED QUINOLINES F. Hoffmann-Roche AG (CH) 2007-06-06 EP claimed
US-20060063804-A1 Thiazolinone 2-substituted quinolines CHEN LI 2006-03-23 US claimed
WO-2006029863-A1 THIAZOLINONE 2-SUBSTITUTED QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2006-03-23 WO claimed
US-7241893-B2 Thiazolinone 2-substituted quinolines HOFFMAN-LA ROCHE INC. (US) 2007-07-10 US disclosed
US-20060063804-A1 Thiazolinone 2-substituted quinolines CHEN LI 2006-03-23 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-20060063804-A1 Thiazolinone 2-substituted quinolines CDK1, CDK17, CDK12 KMT2A 647/4885MEN1 1507/4885GAA 3853/4885

“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.