SCHEMBL6186726

SCHEMBL6186726

COC(=O)c1ccc(OC(=O)N2CCOc3ccc(C=C4SC(=S)NC4=O)cc32)cc1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIK3CG P48736 7/20 0.48
HSPD1 P10809 1/20 0.48
HSPE1 P61604 1/20 0.48
DYRK1A Q13627 3/20 0.48
CSNK2A2 P19784 2/20 0.48
CLK1 P49759 2/20 0.48
CSNK2B P67870 2/20 0.48
CSNK2A1 P68400 2/20 0.48
DYRK1B Q9Y463 2/20 0.48
DYRK2 Q92630 1/20 0.48
PIM1 P11309 2/20 0.48
TDP1 Q9NUW8 2/20 0.47
MEN1 O00255 1/20 0.47
POLB P06746 1/20 0.47
RAB9A P51151 1/20 0.47
KMT2A Q03164 1/20 0.47
MAOA P21397 1/20 0.43
MAOB P27338 1/20 0.43
CISD1 Q9NZ45 1/20 0.43
CDC7 O00311 1/20 0.43

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
SCHEMBL6186723 1.00 PIK3CG (0.48) PIK3CGHSPD1HSPE1DYRK1ACSNK2A2
SCHEMBL6177603 0.95 PIK3CG (0.47) PIK3CGHSPD1HSPE1DYRK1ACSNK2A2
SCHEMBL6177606 0.95 PIK3CG (0.47) PIK3CGHSPD1HSPE1DYRK1ACSNK2A2
SCHEMBL6185488 0.90 PIK3CG (0.54) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B
SCHEMBL6185491 0.90 PIK3CG (0.54) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B
SCHEMBL6185176 0.88 PIK3CG (0.53) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B
SCHEMBL6185175 0.88 PIK3CG (0.53) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B
SCHEMBL6835909 0.85 PIK3CG (0.53) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B
SCHEMBL6835911 0.85 PIK3CG (0.53) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B
SCHEMBL6185079 0.83 PIK3CG (0.51) PIK3CGDYRK1ACSNK2A2CLK1CSNK2B

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
EP-1581529-A1 BENZOXAZINES AND DERIVATIVES THEREOF AS INHIBITORS OF PI3KS WARNER-LAMBERT COMPANY (US) 2005-10-05 EP claimed
US-20040138199-A1 Benzoxazines and derivatives thereof as therapeutic agents GOGLIOTTI ROCCO DEAN (US) 2004-07-15 US claimed
WO-2004056820-A1 BENZOXAZINES AND DERIVATIVES THEREOF AS INHIBITORS OF PI3KS WARNER-LAMBERT COMPANY LLC (US) 2004-07-08 WO claimed
EP-1581529-A1 BENZOXAZINES AND DERIVATIVES THEREOF AS INHIBITORS OF PI3KS WARNER-LAMBERT COMPANY (US) 2005-10-05 EP disclosed
US-20040138199-A1 Benzoxazines and derivatives thereof as therapeutic agents GOGLIOTTI ROCCO DEAN (US) 2004-07-15 US disclosed
WO-2004056820-A1 BENZOXAZINES AND DERIVATIVES THEREOF AS INHIBITORS OF PI3KS WARNER-LAMBERT COMPANY LLC (US) 2004-07-08 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-20040138199-A1 Benzoxazines and derivatives thereof as therapeutic agents XDH, TBXA2R, TBXAS1 PIK3CG 4543/4885HSPD1 3188/4885HSPE1 2764/4885

“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.