SCHEMBL4874075

SCHEMBL4874075

O=C1N=C(NCC2CC2)S/C1=C\c1ccc2ncccc2c1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CD O00329 2/20 0.51
CSNK2A2 P19784 2/20 0.51
PIK3CA P42336 2/20 0.51
PIK3CG P48736 2/20 0.51
CLK1 P49759 2/20 0.51
CSNK2B P67870 2/20 0.51
CSNK2A1 P68400 2/20 0.51
DYRK1A Q13627 2/20 0.51
DYRK2 Q92630 2/20 0.51
DYRK1B Q9Y463 2/20 0.51
PIM1 P11309 1/20 0.51
CLK3 P49761 1/20 0.51
HASPIN Q8TF76 1/20 0.51
MYLK2 Q9H1R3 1/20 0.51
CLK4 Q9HAZ1 1/20 0.51
STK17A Q9UEE5 1/20 0.51
CDK1 P06493 4/20 0.46
PRKCD Q05655 3/20 0.46
MAPK1 P28482 2/20 0.46
DYRK3 O43781 4/20 0.46

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
SCHEMBL4874080 1.00 PIK3CD (0.51) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL4867566 0.95 PIK3CD (0.48) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL14269714 0.94 PIK3CD (0.48) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL4876310 0.94 PIK3CD (0.48) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL4864028 0.93 DYRK1A (0.47) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL14269715 0.93 DYRK1A (0.47) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL14269717 0.93 PIK3CA (0.46) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL4866271 0.93 PIK3CA (0.46) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL4876375 0.83 PIK3CD (0.50) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1
SCHEMBL5224962 0.82 PIK3CD (0.49) PIK3CDCSNK2A2PIK3CAPIK3CGCLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2008504324-A 2008-02-14 JP claimed
US-7326786-B2 Thiazolinone unsubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2008-02-05 US claimed
EP-1765817-A1 THIAZOLINONE UNSUBSTITUTED QUINOLINES F.HOFFMANN-LA ROCHE AG (CH) 2007-03-28 EP claimed
WO-2006002829-A1 THIAZOLINONE UNSUBSTITUTED QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2006-01-12 WO claimed
US-20060004045-A1 Thiazolinone unsubstituted quinolines CHEN LI 2006-01-05 US claimed
US-7326786-B2 Thiazolinone unsubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2008-02-05 US disclosed
US-7326786-B2 Thiazolinone unsubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2008-02-05 US disclosed
US-7326786-B2 Thiazolinone unsubstituted quinolines HOFFMANN-LA ROCHE INC. (US) 2008-02-05 US disclosed
EP-1765817-A1 THIAZOLINONE UNSUBSTITUTED QUINOLINES F.HOFFMANN-LA ROCHE AG (CH) 2007-03-28 EP disclosed
WO-2006002829-A1 THIAZOLINONE UNSUBSTITUTED QUINOLINES F. HOFFMANN-LA ROCHE AG (CH) 2006-01-12 WO disclosed
US-20060004045-A1 Thiazolinone unsubstituted quinolines CHEN LI 2006-01-05 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-20060004045-A1 Thiazolinone unsubstituted quinolines CDK1, CDK17, CDK14 PIK3CD 1263/4885CSNK2A2 195/4885PIK3CA 891/4885

“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.